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

*Links on SpectraBase are not permalinks.
3-Chloro-4,4-dimethylbicyclo[3.2.1]octa-2,6-diene
SpectraBase Compound ID BgpSvHtP3Ht
InChI InChI=1S/C10H13Cl/c1-10(2)8-4-3-7(5-8)6-9(10)11/h3-4,6-8H,5H2,1-2H3/t7-,8+/m1/s1
InChIKey YUXCOLZCGCHODU-SFYZADRCSA-N
Mol Weight 168.67 g/mol
Molecular Formula C10H13Cl
Exact Mass 168.070578 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 4WjqJXdbxg
Name 3-Chloro-4,4-dimethylbicyclo[3.2.1]octa-2,6-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13Cl
InChI InChI=1S/C10H13Cl/c1-10(2)8-4-3-7(5-8)6-9(10)11/h3-4,6-8H,5H2,1-2H3/t7-,8+/m1/s1
InChIKey YUXCOLZCGCHODU-SFYZADRCSA-N
Literature Reference DOI 10.1002/cber.19821151104
Molecular Weight 168.667 g/mol
SMILES [C@@]12(C=C[C@@](C2)(C(C(=C1)Cl)(C)C)[H])[H]
SPLASH splash10-015c-2900000000-7e8fcb7f6420553e64eb
Source of Spectrum K-115-3511-13a
Synonyms (1S,5R)-3-chloro-4,4-dimethylbicyclo[3.2.1]octa-2,6-diene
Wiley ID 1791889