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

*Links on SpectraBase are not permalinks.
4-Cyanophenyl 4-ethylbenzoate
SpectraBase Compound ID AhZzTrfjuRm
InChI InChI=1S/C16H13NO2/c1-2-12-3-7-14(8-4-12)16(18)19-15-9-5-13(11-17)6-10-15/h3-10H,2H2,1H3
InChIKey ULFIAHFQEURGOU-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C16H13NO2
Exact Mass 251.094629 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 1dOhz44jXZ9
Name 4-Cyanophenyl 4-ethylbenzoate
Alternate Name(s) 4-Ethylbenzoic acid (4-cyanophenyl) ester Benzoic acid, 4-ethyl-, 4-cyanophenyl ester
CAS Registry Number 56131-48-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO2
InChI InChI=1S/C16H13NO2/c1-2-12-3-7-14(8-4-12)16(18)19-15-9-5-13(11-17)6-10-15/h3-10H,2H2,1H3
InChIKey ULFIAHFQEURGOU-UHFFFAOYSA-N
Molecular Weight 251.285 g/mol
SMILES c1c(ccc(OC(c2ccc(CC)cc2)=O)c1)C#N
SPLASH splash10-001i-5900000000-caf4a447999dfa3abe40
Wiley ID 1476051