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5-(Phenylthio)-3,3a,4,7a-tetrahydro-2H-indene-1,7-dione
SpectraBase Compound ID 3ZrnWmiOVkW
InChI InChI=1S/C15H14O2S/c16-13-7-6-10-8-12(9-14(17)15(10)13)18-11-4-2-1-3-5-11/h1-5,9-10,15H,6-8H2
InChIKey WGWRVZQCVOPSJA-UHFFFAOYSA-N
Mol Weight 258.33 g/mol
Molecular Formula C15H14O2S
Exact Mass 258.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22sOXfFoe9n
Name 5-(Phenylthio)-3,3a,4,7a-tetrahydro-2H-indene-1,7-dione
Alternate Name(s) 5-(Phenylthio)-3,3a,4,7a-tetrahydro-2H-indene-1,7-quinone 5-Phenylsulfanyl-3,3a,4,7a-tetrahydro-2H-indene-1,7-dione
CAS Registry Number 105090-15-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O2S
InChI InChI=1S/C15H14O2S/c16-13-7-6-10-8-12(9-14(17)15(10)13)18-11-4-2-1-3-5-11/h1-5,9-10,15H,6-8H2
InChIKey WGWRVZQCVOPSJA-UHFFFAOYSA-N
Molecular Weight 258.335 g/mol
SMILES C1(C=C(Sc2ccccc2)CC2C1C(CC2)=O)=O
SPLASH splash10-0a4i-0590000000-c2f2afc639142d6b0805
Source of Spectrum J-54-3243-5
Wiley ID 1261796