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3,6-Dichloro-1-benzothiophene-2-carboxylic acid
SpectraBase Compound ID DvQHdOHHsQ2
InChI InChI=1S/C9H4Cl2O2S/c10-4-1-2-5-6(3-4)14-8(7(5)11)9(12)13/h1-3H,(H,12,13)
InChIKey AAHPIJMQJAZYTM-UHFFFAOYSA-N
Mol Weight 247.09 g/mol
Molecular Formula C9H4Cl2O2S
Exact Mass 245.930906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WsjW4J4UDZ
Name 3,6-Dichloro-1-benzothiophene-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4Cl2O2S
InChI InChI=1S/C9H4Cl2O2S/c10-4-1-2-5-6(3-4)14-8(7(5)11)9(12)13/h1-3H,(H,12,13)
InChIKey AAHPIJMQJAZYTM-UHFFFAOYSA-N
Molecular Weight 247.095 g/mol
SMILES OC(c1sc2c(c1Cl)ccc(c2)Cl)=O
SPLASH splash10-0udi-6390000000-90e4c09fdef68476e6d7
Synonyms 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylic acid 3,6-Dichloro-benzo[b]thiophene-2-carboxylic acid 3,6-Dichlorobenzothiophene-2-carboxylic acid
Wiley ID 1456951