![Carbamothioic acid, [5-[4-[1-(ethoxyimino)butyl]-3-hydroxy-5-oxo-3-cyclohexen-1-yl]-2-methoxyphenyl]-, S-methyl ester](/api/spectrum/LZyg4Y27B4H/structure.png?h=300&w=458 "Carbamothioic acid, [5-[4-[1-(ethoxyimino)butyl]-3-hydroxy-5-oxo-3-cyclohexen-1-yl]-2-methoxyphenyl]-, S-methyl ester")
| SpectraBase Compound ID | CbnUthL717j |
|---|---|
| InChI | InChI=1S/C21H28N2O5S/c1-5-7-15(23-28-6-2)20-17(24)11-14(12-18(20)25)13-8-9-19(27-3)16(10-13)22-21(26)29-4/h8-10,14,24H,5-7,11-12H2,1-4H3,(H,22,26) |
| InChIKey | LVIPCYDZTJUGST-UHFFFAOYSA-N |
| Mol Weight | 420.52 g/mol |
| Molecular Formula | C21H28N2O5S |
| Exact Mass | 420.171893 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | LZyg4Y27B4H |
|---|---|
| Name | Carbamothioic acid, [5-[4-[1-(ethoxyimino)butyl]-3-hydroxy-5-oxo-3-cyclohexen-1-yl]-2-methoxyphenyl]-, S-methyl ester |
| CAS Registry Number | 102768-57-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C21H28N2O5S |
| InChI | InChI=1S/C21H28N2O5S/c1-5-7-15(23-28-6-2)20-17(24)11-14(12-18(20)25)13-8-9-19(27-3)16(10-13)22-21(26)29-4/h8-10,14,24H,5-7,11-12H2,1-4H3,(H,22,26) |
| InChIKey | LVIPCYDZTJUGST-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |