SpectraBase Compound ID | 3LifU96ftt4 |
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InChI | InChI=1S/C13H14O5S2/c1-9-3-5-10(6-4-9)20(15,16)18-12-8-19-7-11(12)13(14)17-2/h3-6H,7-8H2,1-2H3 |
InChIKey | WSUNYXZGRAAUQR-UHFFFAOYSA-N |
Mol Weight | 314.37 g/mol |
Molecular Formula | C13H14O5S2 |
Exact Mass | 314.028266 g/mol |
SpectraBase Spectrum ID | 86AzsP4kNHb |
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Name | 3-Thiophenecarboxylic acid, 2,5-dihydro-4-[[(4-methylphenyl)sulfonyl]oxy]-, methyl ester |
CAS Registry Number | 67525-75-1 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H14O5S2 |
InChI | InChI=1S/C13H14O5S2/c1-9-3-5-10(6-4-9)20(15,16)18-12-8-19-7-11(12)13(14)17-2/h3-6H,7-8H2,1-2H3 |
InChIKey | WSUNYXZGRAAUQR-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |