SpectraBase Compound ID | FjM24pfbsNP |
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InChI | InChI=1S/C13H18O5S/c1-3-9(14)12-10(15)6-8(7-11(12)16)13(17)19-5-4-18-2/h8,15H,3-7H2,1-2H3 |
InChIKey | QUNKNMBATGWPQX-UHFFFAOYSA-N |
Mol Weight | 286.34 g/mol |
Molecular Formula | C13H18O5S |
Exact Mass | 286.087495 g/mol |
SpectraBase Spectrum ID | AxpxjMUvihH |
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Name | 3-Cyclohexene-1-carbothioic acid, 3-hydroxy-5-oxo-4-(1-oxopropyl)-,S-(2-methoxyethyl) ester |
CAS Registry Number | 120074-15-9 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H18O5S |
InChI | InChI=1S/C13H18O5S/c1-3-9(14)12-10(15)6-8(7-11(12)16)13(17)19-5-4-18-2/h8,15H,3-7H2,1-2H3 |
InChIKey | QUNKNMBATGWPQX-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 |
Purity | slightly contaminated |
Technique | Film |