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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)

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SpectraBase Spectrum ID GVmz7hX3RBp
Name 4-Cyanophenyl 4-ethylbenzoate
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-3900000000-9eb8c2d2789d875a4cca
Source of Spectrum O-26-146-45
Synonyms 4-Ethylbenzoic acid (4-cyanophenyl) ester Benzoic acid, 4-ethyl-, 4-cyanophenyl ester
Wiley ID 1254700