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

*Links on SpectraBase are not permalinks.
9-endo-(Phenylthio)-exo-tricyclo[6.1.1.0(2,7)]decane
SpectraBase Compound ID 9xi6DaQMyqO
InChI InChI=1S/C16H20S/c1-2-6-11(7-3-1)17-16-14-10-15(16)13-9-5-4-8-12(13)14/h1-3,6-7,12-16H,4-5,8-10H2/t12-,13+,14-,15+,16+
InChIKey MVKDSRPUZAAPQS-HUSMAVQQSA-N
Mol Weight 244.4 g/mol
Molecular Formula C16H20S
Exact Mass 244.128572 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 obMEmYyXif
Name 9-endo-(Phenylthio)-exo-tricyclo[6.1.1.0(2,7)]decane
Alternate Name(s) ((1S,2S,3S,3aR,7aS)-octahydro-1H-1,3-methanoinden-2-yl)(phenyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20S
InChI InChI=1S/C16H20S/c1-2-6-11(7-3-1)17-16-14-10-15(16)13-9-5-4-8-12(13)14/h1-3,6-7,12-16H,4-5,8-10H2/t12-,13+,14-,15+,16+
InChIKey MVKDSRPUZAAPQS-HUSMAVQQSA-N
Literature Reference DOI 10.1002/cber.19791120611
Molecular Weight 244.396 g/mol
SMILES [C@@]12([C@]([C@@]([C@]3([C@@]2(CCCC3)[H])[H])(C1)[H])(Sc1ccccc1)[H])[H]
SPLASH splash10-002f-9410000000-87d11dc091d13404a474
Source of Spectrum K-112-2020-19
Wiley ID 1794337