For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2H-Cyclohepta[b]furan-3-carbonitrile, 3,4,5,6,7,8-hexahydro-2-phenyl-, trans-
SpectraBase Compound ID EP9A4XhSEcu
InChI InChI=1S/C16H17NO/c17-11-14-13-9-5-2-6-10-15(13)18-16(14)12-7-3-1-4-8-12/h1,3-4,7-8,14,16H,2,5-6,9-10H2/t14-,16+/m0/s1
InChIKey VACAKZATTCVOEV-GOEBONIOSA-N
Mol Weight 239.32 g/mol
Molecular Formula C16H17NO
Exact Mass 239.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Dzrh2wEzfYz
Name 2H-Cyclohepta[b]furan-3-carbonitrile, 3,4,5,6,7,8-hexahydro-2-phenyl-, trans-
CAS Registry Number 70388-75-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO
InChI InChI=1S/C16H17NO/c17-11-14-13-9-5-2-6-10-15(13)18-16(14)12-7-3-1-4-8-12/h1,3-4,7-8,14,16H,2,5-6,9-10H2/t14-,16+/m0/s1
InChIKey VACAKZATTCVOEV-GOEBONIOSA-N
Molecular Weight 239.318 g/mol
SMILES C1=2O[C@@]([C@](C2CCCCC1)(C#N)[H])(c1ccccc1)[H]
SPLASH splash10-000i-0390000000-870bf56e02c22511d032
Source of Spectrum K-113-898-0
Synonyms (2S,3R)-2-phenyl-3,4,5,6,7,8-hexahydro-2H-cyclohepta[b]furan-3-carbonitrile trans-2-phenyl-3,4,5,6,7,8-hexahydro-2H-cyclohepta[b]furan-3,3-carbonitrile
Wiley ID 1242141