![Benzoic acid, 2-[[[[[4-methoxy-6-(trifluoromethyl)-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, propyl ester](/api/spectrum/2RKTNEheeSB/structure.png?h=300&w=458 "Benzoic acid, 2-[[[[[4-methoxy-6-(trifluoromethyl)-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, propyl ester")
| SpectraBase Compound ID | k09QQ5DtDW |
|---|---|
| InChI | InChI=1S/C17H17F3N4O6S/c1-3-8-30-14(25)10-6-4-5-7-11(10)31(27,28)24-16(26)23-15-21-12(17(18,19)20)9-13(22-15)29-2/h4-7,9H,3,8H2,1-2H3,(H2,21,22,23,24,26) |
| InChIKey | CRYKIORBUQMDCW-UHFFFAOYSA-N |
| Mol Weight | 462.4 g/mol |
| Molecular Formula | C17H17F3N4O6S |
| Exact Mass | 462.08209 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 2RKTNEheeSB |
|---|---|
| Name | Benzoic acid, 2-[[[[[4-methoxy-6-(trifluoromethyl)-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, propyl ester |
| CAS Registry Number | 126655-57-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C17H17F3N4O6S |
| InChI | InChI=1S/C17H17F3N4O6S/c1-3-8-30-14(25)10-6-4-5-7-11(10)31(27,28)24-16(26)23-15-21-12(17(18,19)20)9-13(22-15)29-2/h4-7,9H,3,8H2,1-2H3,(H2,21,22,23,24,26) |
| InChIKey | CRYKIORBUQMDCW-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |