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2-Propenoic acid, 3-(2,3-dihydro-1H-inden-5-yl)-2-mercapto-
SpectraBase Compound ID 92gYBrD93De
InChI InChI=1S/C12H12O2S/c13-12(14)11(15)7-8-4-5-9-2-1-3-10(9)6-8/h4-7,15H,1-3H2,(H,13,14)/b11-7-
InChIKey JBLROVRWAYDDEU-XFFZJAGNSA-N
Mol Weight 220.29 g/mol
Molecular Formula C12H12O2S
Exact Mass 220.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BEh3yJHp8lt
Name 2-Propenoic acid, 3-(2,3-dihydro-1H-inden-5-yl)-2-mercapto-
CAS Registry Number 62245-78-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O2S
InChI InChI=1S/C12H12O2S/c13-12(14)11(15)7-8-4-5-9-2-1-3-10(9)6-8/h4-7,15H,1-3H2,(H,13,14)/b11-7-
InChIKey JBLROVRWAYDDEU-XFFZJAGNSA-N
Molecular Weight 220.286 g/mol
SMILES OC(\C(=C\c1cc2CCCc2cc1)S)=O
SPLASH splash10-00di-0920000000-b313109797dafaa2e3d9
Source of Spectrum Y-13-1162-0
Wiley ID 1219628