Exact Mass: 87.0684104
Exact Mass Matches: 87.0684104
Found 126 metabolites which its exact mass value is equals to given mass value 87.0684104,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
3-Methyl-1-butylamine
3-Methyl-1-butylamine, also known as isoamylamine or 3,3-dimethylpropylamine, belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group. A primary aliphatic amine that is butan-1-amine carrying a methyl substituent at position 3. 3-Methyl-1-butylamine is an ammonia and unpleasant tasting compound. 3-methyl-1-butylamine has been detected, but not quantified, in several different foods, such as green vegetables, black elderberries, root vegetables, corns, and french plantains. This could make 3-methyl-1-butylamine a potential biomarker for the consumption of these foods. 3-Methyl-1-butylamine is widespread in fungi and higher plants e.g. apple, banana, wine grape, swede, rhubarb, porcini (Boletus edulis). 3-Methyl-1-butylamine is found in many foods, some of which are black elderberry, root vegetables, french plantain, and spinach. KEIO_ID I039
Morpholine
Morpholine is a permitted (FDA) in edible coatings for fruit and vegetables. Morpholine is a food contaminant arising from its use as a boiler water additive Morpholine is a common additive, in ppm concentrations, for pH adjustment in both fossil fuel and nuclear power plant steam systems. Morpholine is used because its volatility is about the same as water, so once it is added to the water, its concentration becomes distributed rather evenly in both the water and steam phases. Its pH adjusting qualities then become distributed throughout the steam plant to provide corrosion protection. Morpholine is often used in conjunction with low concentrations of hydrazine or ammonia to provide a comprehensive all-volatile treatment chemistry for corrosion protection for the steam systems of such plants. Morpholine decomposes reasonably slowly in the absence of oxygen even at the high temperatures and pressures in these steam systems. Morpholine is an organic chemical compound having the chemical formula O(CH2CH2)2NH. This heterocycle, pictured at right, features both amine and ether functional groups. Because of the amine, morpholine is a base; its conjugate acid is called morpholinium. For example, when morpholine is neutralized by hydrochloric acid, one obtains the salt morpholinium chloride. Morpholine is widely used in organic synthesis. For example, it is a building block in the preparation of the antibiotic linezolid and the anticancer agent gefitinib (Iressa) Permitted (FDA) in edible coatings for fruit and vegetables. Food contaminant arising from its use as a boiler water additive CONFIDENCE standard compound; INTERNAL_ID 8365
4-Aminobutyraldehyde
4-Aminobutyraldehyde is a metabolite of putrescine. It is a substrate of human liver aldehyde dehydrogenase (EC 1.2.1.3) cytoplasmic (E1) and mitochondrial (E2) isozymes (PMID 3324802). [HMDB]. 4-Aminobutyraldehyde is found in many foods, some of which are naranjilla, rambutan, oval-leaf huckleberry, and pepper (capsicum). 4-Aminobutyraldehyde is a metabolite of putrescine. It is a substrate of human liver aldehyde dehydrogenase (EC 1.2.1.3) cytoplasmic (E1) and mitochondrial (E2) isozymes (PMID 3324802).
2-Aminoacrylic acid
Dehydroalanine (or (alpha)-(beta)-di-dehydroalanine) is an uncommon amino acid found in peptides of microbial origin (an unsaturated amino acid). [HMDB] Dehydroalanine (or (alpha)-(beta)-di-dehydroalanine) is an uncommon amino acid found in peptides of microbial origin (an unsaturated amino acid).
2-Oxazolidinone
D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors D000890 - Anti-Infective Agents > D023303 - Oxazolidinones
N,N-DIMETHYLACETAMIDE
D020011 - Protective Agents > D003451 - Cryoprotective Agents
N-Ethylacetamide
N-Ethylacetamide is found in alcoholic beverages. N-Ethylacetamide is found in tea and win
3-Isoxazolidinone
3-Isoxazolidinone is found in pulses. 3-Isoxazolidinone is isolated from seedlings of Canavalia ensiformis (jack bean). Isolated from seedlings of Canavalia ensiformis (jack bean). 3-Isoxazolidinone is found in pulses. D000890 - Anti-Infective Agents > D023303 - Oxazolidinones
2-Methylbutylamine
2-Methylbutylamine is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
Butyramide
Butyramide is the amide of butyric acid. It has the molecular formula C3H7CONH2. It is a clear liquid that is highly soluble in water and ethanol, but slightly soluble in diethyl ether. At room temperature, butyramide is a crystalline solid. (Wikipedia). Butyramide is the amide of butyric acid. It has the molecular formula C3H7CONH2. It is a clear liquid that is highly soluble in water and ethanol, but slightly soluble in diethyl ether. At room temperature, butyramide is a crystalline solid.
Amylamine
Amylamine, also known as 1-pentylamine or 1-aminopentane, is a member of the class of compounds known as monoalkylamines. Monoalkylamines are organic compounds containing an primary aliphatic amine group. Amylamine is soluble (in water) and a very strong basic compound (based on its pKa). Amylamine is an ammoniacal and fishy tasting compound and can be found in a number of food items such as yellow bell pepper, apple, pepper (c. annuum), and cabbage, which makes amylamine a potential biomarker for the consumption of these food products. Amylamine is a chemical compound with the formula CH3(CH2)4NH2. It is used as a solvent, as a raw material in the manufacture of a variety of other compounds, including dyes, emulsifiers, and pharmaceutical products, and as a flavoring agent .
n-methylbutan-2-amine
A secondary aliphatic amine that is sec-butylamine substituted by a methyl group at the N atom. Metabolite observed in cancer metabolism.
tert-amylamine
A primary aliphatic amine that is butan-2-amine substituted by a methyl group at position 2. Metabolite observed in cancer metabolism.
Butyrate
A short-chain fatty acid anion that is the conjugate base of butyric acid, obtained by deprotonation of the carboxy group.
Ethyl acetimidate
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D007096 - Imidoesters
N,N-DIMETHYLACETAMIDE
A member of the class of acetamides that is acetamide in which the hydrogens attached to the N atom have been replaced by two methyl groups respectively. Metabolite observed in cancer metabolism. D020011 - Protective Agents > D003451 - Cryoprotective Agents
Isopentylamine
A primary aliphatic amine that is butan-1-amine carrying a methyl substituent at position 3.
N-ETHYLACETAMIDE
A member of the class of acetamides that is the N-ethyl derivative of acetamide.
oxazolidinone
An oxazolidinone that is 1,3-oxazolidine with an oxo substituent at position 2. D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors D000890 - Anti-Infective Agents > D023303 - Oxazolidinones
4-aminobutanal
An omega-aminoaldehyde that is butanal in which one of the hydrogens of the terminal methyl group has been replaced by an amino group.
Isobutyrate
A branched, short-chain, saturated fatty acid anion; the conjugate base of isobutyric acid, formed by deprotonation of the carboxylic acid group.
fatty acid anion 4:0
Any saturated fatty acid anion containing 4 carbons. Formed by deprotonation of the carboxylic acid moiety. Major species at pH 7.3.
2-ammonioprop-2-enoate
An amino acid zwitterion resulting from a transfer of a proton from the carboxy group to the amino group of 2-aminoacrylic acid.
2-iminopropionic acid
A dehydroamino acid that is alanine in which the amino group has been oxidised to the corresponding imine.
pentan-3-amine
A primary aliphatic amine that is pentane substituted by an amino group at position 3. Metabolite observed in cancer metabolism.
2-iminiopropionate
A zwitterion resulting from the transfer of a proton from the carboxy group to the nitrogen of 2-iminopropionic acid.
2-Aminoacrylic acid
A 2,3-dehydroamino acid that is alanine which has been dehydrogenated to introduce a double bond between positions 2 and 3.