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N-Acetyl-N-benzylvaline
SpectraBase Compound ID DTjMbaTIK6O
InChI InChI=1S/C14H19NO3/c1-10(2)13(14(17)18)15(11(3)16)9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3,(H,17,18)
InChIKey FATHCXOHDHQWDM-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GvnQ1qkJyJP
Name N-Acetyl-N-benzylvaline
Comments Less than 3 mono-isotopic peaks
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Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c1-10(2)13(14(17)18)15(11(3)16)9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3,(H,17,18)
InChIKey FATHCXOHDHQWDM-UHFFFAOYSA-N
Molecular Weight 249.310 g/mol
SMILES OC(C(N(C(=O)C)Cc1ccccc1)C(C)C)=O
SPLASH splash10-0006-9000000000-9aa542ff53d6ee4fc321
Source of Spectrum H1-45-2189-1
Synonyms 2-[acetyl-(phenylmethyl)amino]-3-methylbutanoic acid 2-[acetyl(benzyl)amino]-3-methylbutanoic acid 2-[acetyl(benzyl)amino]-3-methyl-butanoic acid 2-[ethanoyl-(phenylmethyl)amino]-3-methyl-butanoic acid
Wiley ID 815916