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2-Benzylhept-6-enenitrile

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2-Benzylhept-6-enenitrile
SpectraBase Compound ID CPXefGcbFcz
InChI InChI=1S/C14H17N/c1-2-3-5-10-14(12-15)11-13-8-6-4-7-9-13/h2,4,6-9,14H,1,3,5,10-11H2
InChIKey VRLPOUWCRNIKGN-UHFFFAOYSA-N
Mol Weight 199.3 g/mol
Molecular Formula C14H17N
Exact Mass 199.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4arUiR3RdaT
Name 2-Benzylhept-6-enenitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N
InChI InChI=1S/C14H17N/c1-2-3-5-10-14(12-15)11-13-8-6-4-7-9-13/h2,4,6-9,14H,1,3,5,10-11H2
InChIKey VRLPOUWCRNIKGN-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/anie.201908372
Molecular Weight 199.297 g/mol
Reported Formula C14H17N
SMILES c1(ccccc1)CC(C#N)CCCC=C
SPLASH splash10-0006-9200000000-ec297291319ec7462fff
Source of Spectrum ACI-58-SM14-5
Wiley ID 1875699