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1-Phenylsulfonyl-3-((4',6'-dimethyl-3-cyclohexenyl)carbonyl)-indole
SpectraBase Compound ID 9qkdNArekuw
InChI InChI=1S/C23H23NO3S/c1-16-12-13-19(17(2)14-16)23(25)21-15-24(22-11-7-6-10-20(21)22)28(26,27)18-8-4-3-5-9-18/h3-12,15,17,19H,13-14H2,1-2H3
InChIKey FXVAFDQNTCJPSV-UHFFFAOYSA-N
Mol Weight 393.5 g/mol
Molecular Formula C23H23NO3S
Exact Mass 393.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ai0rA5u3OE
Name 1-Phenylsulfonyl-3-((4',6'-dimethyl-3-cyclohexenyl)carbonyl)-indole
CAS Registry Number 116325-38-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23NO3S
InChI InChI=1S/C23H23NO3S/c1-16-12-13-19(17(2)14-16)23(25)21-15-24(22-11-7-6-10-20(21)22)28(26,27)18-8-4-3-5-9-18/h3-12,15,17,19H,13-14H2,1-2H3
InChIKey FXVAFDQNTCJPSV-UHFFFAOYSA-N
Molecular Weight 393.501 g/mol
SMILES c1(S([n]2cc(C(C3C(CC(=CC3)C)C)=O)c3c2cccc3)(=O)=O)ccccc1
SPLASH splash10-003u-3691000000-3a3b947b9a8704cc9ab9
Source of Spectrum C-110-7193-23
Synonyms (4,6-dimethyl-3-cyclohexen-1-yl)[1-(phenylsulfonyl)-1H-indol-3-yl]methanone
Wiley ID 1366304