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

*Links on SpectraBase are not permalinks.
3-benzylidene-6,6-dimethyl-norpinan-2-one
SpectraBase Compound ID BQdHyiGBBmB
InChI InChI=1S/C16H18O/c1-16(2)13-9-12(15(17)14(16)10-13)8-11-6-4-3-5-7-11/h3-8,13-14H,9-10H2,1-2H3
InChIKey NKWTXASMNZHMLU-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 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 4KoLxI7ATA
Name 3-benzylidene-6,6-dimethyl-norpinan-2-one
Appearance Colorless transparent crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-16(2)13-9-12(15(17)14(16)10-13)8-11-6-4-3-5-7-11/h3-8,13-14H,9-10H2,1-2H3
InChIKey NKWTXASMNZHMLU-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 226.319 g/mol
Optical Rotation [a]D20 = -12.3 (c = 1.0, CHCl3)
SMILES c1(C=C2C(C3C(C(C3)C2)(C)C)=O)ccccc1
SPLASH splash10-05r3-4940000000-41e731bd821298bee831
Source of Spectrum CN105085413B
Wiley ID 1870473