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3-(4-Cyanophenyl)cycloheptene
SpectraBase Compound ID 2nNIg0FZQbY
InChI InChI=1S/C14H15N/c15-11-12-7-9-14(10-8-12)13-5-3-1-2-4-6-13/h3,5,7-10,13H,1-2,4,6H2
InChIKey FBOWBABFPDQYRD-UHFFFAOYSA-N
Mol Weight 197.28 g/mol
Molecular Formula C14H15N
Exact Mass 197.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KnRZ42pVgl
Name 3-(4-Cyanophenyl)cycloheptene
Appearance Clear oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N
InChI InChI=1S/C14H15N/c15-11-12-7-9-14(10-8-12)13-5-3-1-2-4-6-13/h3,5,7-10,13H,1-2,4,6H2
InChIKey FBOWBABFPDQYRD-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI positive ion
Literature Reference DOI 10.1021/acs.orglett.1c00812
Molecular Weight 197.281 g/mol
Reported Formula C14H15N
SMILES C1CCCC=CC1c1ccc(cc1)C#N
SPLASH splash10-014i-0900000000-ae13777477111eb46caa
Source of Spectrum A1-23-SM117-12l
Wiley ID 1868194