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(4-cyano-4-pyridin-2-yl-cyclohexen-1-yl) ethanoate
SpectraBase Compound ID 9Bh4YHRPv4g
InChI InChI=1S/C14H14N2O2/c1-11(17)18-12-5-7-14(10-15,8-6-12)13-4-2-3-9-16-13/h2-5,9H,6-8H2,1H3
InChIKey XTAGNMCKADIWQF-UHFFFAOYSA-N
Mol Weight 242.28 g/mol
Molecular Formula C14H14N2O2
Exact Mass 242.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BC1jGG0vbJK
Name (4-cyano-4-pyridin-2-yl-cyclohexen-1-yl) ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2
InChI InChI=1S/C14H14N2O2/c1-11(17)18-12-5-7-14(10-15,8-6-12)13-4-2-3-9-16-13/h2-5,9H,6-8H2,1H3
InChIKey XTAGNMCKADIWQF-UHFFFAOYSA-N
Molecular Weight 242.278 g/mol
SMILES C1(C#N)(c2ncccc2)CC=C(CC1)OC(=O)C
SPLASH splash10-000w-2900000000-05a5e81fbef724588824
Source of Spectrum KC-0-3386-5
Synonyms (4-cyano-4-pyridin-2-ylcyclohexen-1-yl) acetate Acetic acid [4-cyano-4-(2-pyridinyl)-1-cyclohexenyl] ester [4-cyano-4-(2-pyridyl)cyclohexen-1-yl] acetate
Wiley ID 831793