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

*Links on SpectraBase are not permalinks.
Isopropyl 4-cyanobenzoate
SpectraBase Compound ID JIOjk5eKosd
InChI InChI=1S/C11H11NO2/c1-8(2)14-11(13)10-5-3-9(7-12)4-6-10/h3-6,8H,1-2H3
InChIKey NFNBGZCLCQVHRY-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C11H11NO2
Exact Mass 189.078979 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 2uqIFIw0MWx
Name 4-cyanobenzoic acid isopropyl ester
CAS Registry Number 29240-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2
InChI InChI=1S/C11H11NO2/c1-8(2)14-11(13)10-5-3-9(7-12)4-6-10/h3-6,8H,1-2H3
InChIKey NFNBGZCLCQVHRY-UHFFFAOYSA-N
Molecular Weight 189.214 g/mol
SMILES C(OC(C)C)(c1ccc(C#N)cc1)=O
SPLASH splash10-001i-4900000000-f17a966575990f9fd4b9
Source of Spectrum M-32-340-1
Synonyms 4-cyanobenzoic acid propan-2-yl ester Isopropyl 4-cyanobenzoate Propan-2-yl 4-cyanobenzoate
Wiley ID 1185706