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2-Propenedithioic acid, 3-(3-bromophenyl)-3-hydroxy-
SpectraBase Compound ID 21vVZcC5POo
InChI InChI=1S/C9H7BrOS2/c10-7-3-1-2-6(4-7)8(11)5-9(12)13/h1-5,11H,(H,12,13)/b8-5-
InChIKey XQPYGCKCQRCXOX-YVMONPNESA-N
Mol Weight 275.18 g/mol
Molecular Formula C9H7BrOS2
Exact Mass 273.91217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjecmLva0go
Name 2-Propenedithioic acid, 3-(3-bromophenyl)-3-hydroxy-
CAS Registry Number 55256-28-5
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7BrOS2
InChI InChI=1S/C9H7BrOS2/c10-7-3-1-2-6(4-7)8(11)5-9(12)13/h1-5,11H,(H,12,13)/b8-5-
InChIKey XQPYGCKCQRCXOX-YVMONPNESA-N
Molecular Weight 275.178 g/mol
SMILES O\C(=C/C(S)=S)c1cc(Br)ccc1
SPLASH splash10-0a7r-3920000000-c271a0a3c11f06649be0
Source of Spectrum F-28-5349-6
Synonyms (2Z)-3-(3-Bromophenyl)-3-hydroxy-2-propenedithioic acid
Wiley ID 39795