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N-Benzylvaline

View entire compound with spectra: 1 MS (GC)

N-Benzylvaline
SpectraBase Compound ID 7qfwZfCz9UA
InChI InChI=1S/C12H17NO2/c1-9(2)11(12(14)15)13-8-10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3,(H,14,15)
InChIKey FJBAOZHBRMLMCP-UHFFFAOYSA-N
Mol Weight 207.27 g/mol
Molecular Formula C12H17NO2
Exact Mass 207.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6U4PEcE4rM
Name N-Benzylvaline
Alternate Name(s) 2-(benzylamino)-3-methyl-butanoic acid 2-(benzylamino)-3-methyl-butyric acid 3-Methyl-2-[(phenylmethyl)amino]butanoic acid Valine, N-benzyl-
CAS Registry Number 22711-77-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO2
InChI InChI=1S/C12H17NO2/c1-9(2)11(12(14)15)13-8-10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3,(H,14,15)
InChIKey FJBAOZHBRMLMCP-UHFFFAOYSA-N
Molecular Weight 207.273 g/mol
SMILES N(Cc1ccccc1)C(C(=O)O)C(C)C
SPLASH splash10-0006-9300000000-56eaa258fbc554aabe87
Wiley ID 1492587