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

*Links on SpectraBase are not permalinks.
Phenylalanine, N-(3,5-dinitrobenzoyl)-, 10-undecen-1-yl ester
SpectraBase Compound ID 81LbuTfvuf3
InChI InChI=1S/C27H33N3O7/c1-2-3-4-5-6-7-8-9-13-16-37-27(32)25(17-21-14-11-10-12-15-21)28-26(31)22-18-23(29(33)34)20-24(19-22)30(35)36/h2,10-12,14-15,18-20,25H,1,3-9,13,16-17H2,(H,28,31)
InChIKey HQVFRKKKNRGXTD-UHFFFAOYSA-N
Mol Weight 511.6 g/mol
Molecular Formula C27H33N3O7
Exact Mass 511.23185 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 kvULYHxQtM
Name PHENYLALANINE, N-(3,5-DINITROBENZOYL)-, 10-UNDECEN-1-YL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H33O7N3
InChI InChI=1S/C27H33N3O7/c1-2-3-4-5-6-7-8-9-13-16-37-27(32)25(17-21-14-11-10-12-15-21)28-26(31)22-18-23(29(33)34)20-24(19-22)30(35)36/h2,10-12,14-15,18-20,25H,1,3-9,13,16-17H2,(H,28,31)
InChIKey HQVFRKKKNRGXTD-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 511.2310
SMILES N(C(C(OCCCCCCCCCC=C)=O)Cc1ccccc1)C(=O)c1cc(N(=O)=O)cc(N(=O)=O)c1
SPLASH splash10-0005-7911000000-ffc8a570d0db72904c06
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany