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

*Links on SpectraBase are not permalinks.
2-Methyl-4-nitro-3-phenylbutyric acid, t-butyl ester
SpectraBase Compound ID IKJU5UAa3tl
InChI InChI=1S/C15H21NO4/c1-11(14(17)20-15(2,3)4)13(10-16(18)19)12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3
InChIKey XOWDXNPRZCDUGN-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C15H21NO4
Exact Mass 279.147058 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 3f56z5MmL8X
Name 2-METHYL-4-NITRO-3-PHENYLBUTYRIC ACID, tert-BUTYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H21NO4
InChI InChI=1S/C15H21NO4/c1-11(14(17)20-15(2,3)4)13(10-16(18)19)12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3
InChIKey XOWDXNPRZCDUGN-UHFFFAOYSA-N
Molecular Weight 279.1465
SMILES C(N(=O)=O)C(C(C(OC(C)(C)C)=O)C)c1ccccc1
SPLASH splash10-0a6r-7900000000-8c8132d6b2943f3f5bcf
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany