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Benzo[b]thiophene-2-carboxylic acid, 3-hydroxy-, ethyl ester
SpectraBase Compound ID 2zjzcI19JTp
InChI InChI=1S/C11H10O3S/c1-2-14-11(13)10-9(12)7-5-3-4-6-8(7)15-10/h3-6,12H,2H2,1H3
InChIKey KRXONUVWZRBHQR-UHFFFAOYSA-N
Mol Weight 222.26 g/mol
Molecular Formula C11H10O3S
Exact Mass 222.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJdcKW8vV4A
Name Benzo[b]thiophene-2-carboxylic acid, 3-hydroxy-, ethyl ester
Alternate Name(s) Ethyl 3-hydroxy-1-benzothiophene-2-carboxylate 3-Hydroxy-1-benzothiophene-2-carboxylic acid ethyl ester Ethyl 3-hydroxybenzothiophene-2-carboxylate Ethyl 3-oxidanyl-1-benzothiophene-2-carboxylate
CAS Registry Number 5556-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O3S
InChI InChI=1S/C11H10O3S/c1-2-14-11(13)10-9(12)7-5-3-4-6-8(7)15-10/h3-6,12H,2H2,1H3
InChIKey KRXONUVWZRBHQR-UHFFFAOYSA-N
Molecular Weight 222.258 g/mol
SMILES Oc1c(sc2ccccc12)C(=O)OCC
SPLASH splash10-00b9-0920000000-797004c41008e6b7ff0f
Source of Spectrum F-46-6542-18
Wiley ID 1221967