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(7aR)-7a-Methyl-4-phenylsulfanyl-2,3,7,7a-tetrahydro-6H-indene-1,5-dione
SpectraBase Compound ID IfVcePdyOAS
InChI InChI=1S/C16H16O2S/c1-16-10-9-13(17)15(12(16)7-8-14(16)18)19-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/t16-/m1/s1
InChIKey MWCOZPWLJDAUET-MRXNPFEDSA-N
Mol Weight 272.36 g/mol
Molecular Formula C16H16O2S
Exact Mass 272.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8n600cOoDtI
Name (7aR)-7a-Methyl-4-phenylsulfanyl-2,3,7,7a-tetrahydro-6H-indene-1,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2S
InChI InChI=1S/C16H16O2S/c1-16-10-9-13(17)15(12(16)7-8-14(16)18)19-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/t16-/m1/s1
InChIKey MWCOZPWLJDAUET-MRXNPFEDSA-N
Molecular Weight 272.362 g/mol
SMILES C1(CCC2=C(C(CC[C@@]12C)=O)Sc1ccccc1)=O
SPLASH splash10-03k9-2950000000-8ff7b35c018a46c38fed
Source of Spectrum QC-10-1593-4
Synonyms (7aR)-7a-methyl-4-(phenylsulfanyl)-2,3,7,7a-tetrahydro-1H-indene-1,5(6H)-dione
Wiley ID 871362