For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Butanal, (2s)-2-[N-(benzyloxycarbonyl-(s)-phenylalanyl)amino]-3-methyl-
SpectraBase Compound ID BHSkeUB0GO7
InChI InChI=1S/C22H26N2O4/c1-16(2)20(14-25)23-21(26)19(13-17-9-5-3-6-10-17)24-22(27)28-15-18-11-7-4-8-12-18/h3-12,14,16,19-20H,13,15H2,1-2H3,(H,23,26)(H,24,27)
InChIKey PRMGWBLVIAIDTJ-UHFFFAOYSA-N
Mol Weight 382.46 g/mol
Molecular Formula C22H26N2O4
Exact Mass 382.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4eB6Eq6TFL3
Name 1-BUTANAL, (2S)-2-[N-(BENZYLOXYCARBONYL-(S)-PHENYLALANYL)AMINO]-3-METHYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H26N2O4
InChI InChI=1S/C22H26N2O4/c1-16(2)20(14-25)23-21(26)19(13-17-9-5-3-6-10-17)24-22(27)28-15-18-11-7-4-8-12-18/h3-12,14,16,19-20H,13,15H2,1-2H3,(H,23,26)(H,24,27)
InChIKey PRMGWBLVIAIDTJ-UHFFFAOYSA-N
Molecular Weight 382.1886
SMILES N(C(C(NC(C(C)C)C=O)=O)Cc1ccccc1)C(=O)OCc1ccccc1
SPLASH splash10-0006-9110000000-9c4961cc5ba8eb583d57
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany