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N-(2-Oxo-1,2-dihydro-4-pyrimidinyl)isoleucine

View entire compound with spectra: 1 MS (GC)

N-(2-Oxo-1,2-dihydro-4-pyrimidinyl)isoleucine
SpectraBase Compound ID 7pcXzKpNsDP
InChI InChI=1S/C10H15N3O3/c1-3-6(2)8(9(14)15)12-7-4-5-11-10(16)13-7/h4-6,8H,3H2,1-2H3,(H,14,15)(H2,11,12,13,16)
InChIKey MJWXTXFBHYPRFA-UHFFFAOYSA-N
Mol Weight 225.25 g/mol
Molecular Formula C10H15N3O3
Exact Mass 225.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5u5LN5rGuhG
Name N-(2-Oxo-1,2-dihydro-4-pyrimidinyl)isoleucine
CAS Registry Number 117360-41-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15N3O3
InChI InChI=1S/C10H15N3O3/c1-3-6(2)8(9(14)15)12-7-4-5-11-10(16)13-7/h4-6,8H,3H2,1-2H3,(H,14,15)(H2,11,12,13,16)
InChIKey MJWXTXFBHYPRFA-UHFFFAOYSA-N
Molecular Weight 225.248 g/mol
SMILES N1C(N=C(C=C1)NC(C(=O)O)C(CC)C)=O
SPLASH splash10-0udj-4900000000-316cbf30c77e7435be34
Source of Spectrum NP-5-6050-0
Synonyms 4-[(1-Carboxy-2-methylbutyl)amino]-2(1H)-pyrimidinone 4N-(1-Carboxy-2-methylbutyl)-4-amino-1H-2-oxopyrimidine N-(1H-2-Oxo-pyrimidin-4-yl)-3-methyl-2-aminopentanoic acid 3-Methyl-2-[(2-oxo-1H-pyrimidin-6-yl)amino]pentanoic acid 3-Methyl-2-[(2-oxidanylidene-1H-pyrimidin-6-yl)amino]pentanoic acid
Wiley ID 1104994