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N-Carbobenzoxy-DL-valine

View entire compound with spectra: 7 NMR, 4 FTIR, 1 Raman, and 6 MS (GC)

N-Carbobenzoxy-DL-valine
SpectraBase Compound ID mCLqqr5t0h
InChI InChI=1S/C13H17NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)
InChIKey CANZBRDGRHNSGZ-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IP0jF42raRq
Name N-(BENZYLOXYCARBONYL)VALINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)
InChIKey CANZBRDGRHNSGZ-UHFFFAOYSA-N
Molecular Weight 251.1153
SMILES N(C(C(O)=O)C(C)C)C(=O)OCc1ccccc1
SPLASH splash10-0006-9300000000-a07d6a2f6e59922dc40a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany