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

*Links on SpectraBase are not permalinks.
syn-8-Chloro-2,3-(10,11-dimethoxybenzo)-5,6-benzobicyclo[2.2.2]octa-2,5-dien-anti-7-ol Methanesulfonate
SpectraBase Compound ID 9vjxEw49SGY
InChI InChI=1S/C19H19ClO5S/c1-23-14-8-12-13(9-15(14)24-2)17-11-7-5-4-6-10(11)16(12)18(20)19(17)25-26(3,21)22/h4-9,16-19H,1-3H3/t16-,17+,18-,19-/m1/s1
InChIKey OWBXVUFCDNSUJD-FCGDIQPGSA-N
Mol Weight 394.87 g/mol
Molecular Formula C19H19ClO5S
Exact Mass 394.064173 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 EvASJ9ZXaHk
Name syn-8-Chloro-2,3-(10,11-dimethoxybenzo)-5,6-benzobicyclo[2.2.2]octa-2,5-dien-anti-7-ol Methanesulfonate
Alternate Name(s) 16-chloro-4,5-dimethoxytetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaen-15-yl methanesulfonate
CAS Registry Number 96690-14-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19ClO5S
InChI InChI=1S/C19H19ClO5S/c1-23-14-8-12-13(9-15(14)24-2)17-11-7-5-4-6-10(11)16(12)18(20)19(17)25-26(3,21)22/h4-9,16-19H,1-3H3/t16-,17+,18-,19-/m1/s1
InChIKey OWBXVUFCDNSUJD-FCGDIQPGSA-N
Molecular Weight 394.869 g/mol
SMILES [C@]12([C@]([C@](Cl)([C@](c3c2cccc3)(c2c1cc(c(OC)c2)OC)[H])[H])(OS(=O)(=O)C)[H])[H]
SPLASH splash10-0f7a-5493000000-c41430855f87671911bb
Source of Spectrum J-50-2704-0
Wiley ID 1366526