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

*Links on SpectraBase are not permalinks.
4-Pentenoic acid, 2-methyl-2-nitro-, butyl ester, (.+-.)-
SpectraBase Compound ID 62beQtTSpQS
InChI InChI=1S/C10H17NO4/c1-4-6-8-15-9(12)10(3,7-5-2)11(13)14/h5H,2,4,6-8H2,1,3H3
InChIKey DCPQYQPKYPQJGT-UHFFFAOYSA-N
Mol Weight 215.25 g/mol
Molecular Formula C10H17NO4
Exact Mass 215.115758 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 VHIhEXq9uI
Name 4-Pentenoic acid, 2-methyl-2-nitro-, butyl ester, (.+-.)-
CAS Registry Number 113747-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO4
InChI InChI=1S/C10H17NO4/c1-4-6-8-15-9(12)10(3,7-5-2)11(13)14/h5H,2,4,6-8H2,1,3H3
InChIKey DCPQYQPKYPQJGT-UHFFFAOYSA-N
Molecular Weight 215.249 g/mol
SMILES C(N(=O)=O)(C(=O)OCCCC)(CC=C)C
SPLASH splash10-0cdi-9300000000-007658e6616c99d951fa
Source of Spectrum J-53-2325-2
Synonyms Butyl 2-methyl-2-nitro-4-pentenoate
Wiley ID 1214457