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4-Nonanoylbenzonitrile

View entire compound with spectra: 1 MS (GC)

4-Nonanoylbenzonitrile
SpectraBase Compound ID CznPtI0P4C2
InChI InChI=1S/C16H21NO/c1-2-3-4-5-6-7-8-16(18)15-11-9-14(13-17)10-12-15/h9-12H,2-8H2,1H3
InChIKey NKUNYRKCXUJHEV-UHFFFAOYSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UkTzGpLix2
Name 4-Nonanoylbenzonitrile
Alternate Name(s) 4-(1-Oxononyl)benzonitrile 4-Nonanoylbenzenecarbonitrile 4-Pelargonylbenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-2-3-4-5-6-7-8-16(18)15-11-9-14(13-17)10-12-15/h9-12H,2-8H2,1H3
InChIKey NKUNYRKCXUJHEV-UHFFFAOYSA-N
Molecular Weight 243.350 g/mol
SMILES C(c1ccc(cc1)C(CCCCCCCC)=O)#N
SPLASH splash10-000t-0900000000-6e946116e2d061170afd
Source of Spectrum J-64-3551-27
Wiley ID 1530142