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Benzocyclooctene, 1,4,4a,5,6,7,10,10a-octahydro-6-(phenylsulfonyl)-
SpectraBase Compound ID HxXGCpgcdDz
InChI InChI=1S/C18H22O2S/c19-21(20,17-11-2-1-3-12-17)18-13-7-6-9-15-8-4-5-10-16(15)14-18/h1-7,11-12,15-16,18H,8-10,13-14H2/b7-6-
InChIKey UIHDIPJECNDKEJ-SREVYHEPSA-N
Mol Weight 302.43 g/mol
Molecular Formula C18H22O2S
Exact Mass 302.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID InNMzIMwXnC
Name Benzocyclooctene, 1,4,4a,5,6,7,10,10a-octahydro-6-(phenylsulfonyl)-
Alternate Name(s) 1,4,4a,5,6,7,10,10a-octahydrobenzo[a]cycloocten-6-yl phenyl sulfone 6-(Phenylsulfonyl)-1,4,4a,5,6,7,10,10a-octahydrobenzo[a]cyclooctene
CAS Registry Number 69688-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O2S
InChI InChI=1S/C18H22O2S/c19-21(20,17-11-2-1-3-12-17)18-13-7-6-9-15-8-4-5-10-16(15)14-18/h1-7,11-12,15-16,18H,8-10,13-14H2/b7-6-
InChIKey UIHDIPJECNDKEJ-SREVYHEPSA-N
Molecular Weight 302.432 g/mol
SMILES C1(S(=O)(=O)c2ccccc2)CC2C(CC=CC2)C\C=C/C1
SPLASH splash10-054o-9610000000-5031a15e2f11863bdb90
Source of Spectrum W5-1989-36899-28637
Wiley ID 1304776