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Octanoic acid, 4-cyanophenyl ester

View entire compound with spectra: 1 MS (GC)

Octanoic acid, 4-cyanophenyl ester
SpectraBase Compound ID Jm1M0FwCliD
InChI InChI=1S/C15H19NO2/c1-2-3-4-5-6-7-15(17)18-14-10-8-13(12-16)9-11-14/h8-11H,2-7H2,1H3
InChIKey XRSCWCVKLXEFJB-UHFFFAOYSA-N
Mol Weight 245.32 g/mol
Molecular Formula C15H19NO2
Exact Mass 245.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ynvpK82N6
Name Octanoic acid, 4-cyanophenyl ester
Alternate Name(s) Octanoic acid (4-cyanophenyl) ester (4-cyanophenyl) octanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO2
InChI InChI=1S/C15H19NO2/c1-2-3-4-5-6-7-15(17)18-14-10-8-13(12-16)9-11-14/h8-11H,2-7H2,1H3
InChIKey XRSCWCVKLXEFJB-UHFFFAOYSA-N
Molecular Weight 245.322 g/mol
SMILES CCCCCCCC(Oc1ccc(C#N)cc1)=O
SPLASH splash10-0a6r-9600000000-2609b3c2e63e11d3117f
Source of Spectrum NP-6-8139-0
Wiley ID 1106026