| SpectraBase Spectrum ID |
3mFn9Qwcgt9 |
| Name |
(S)-6-Cyclopropyl-5-fluoro-3-(2-methylsulfanylethyl)-2,9-dioxo-1,2,3,4,6,9-hexahydropyrido[2,3-g]quinoxaline-8-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18FN3O4S |
| InChI |
InChI=1S/C18H18FN3O4S/c1-27-5-4-11-17(24)21-12-6-9-15(13(19)14(12)20-11)22(8-2-3-8)7-10(16(9)23)18(25)26/h6-8,11,20H,2-5H2,1H3,(H,21,24)(H,25,26)/t11-/m0/s1 |
| InChIKey |
ILZABHFWEGNGPP-NSHDSACASA-N |
| Instrument Name |
Finnigan MAT TSQ-70?? |
| Ionization Type |
EI |
| Molecular Weight |
391.417 g/mol |
| Reported Formula |
C18H18FN3O4S |
| SMILES |
N1C([C@@](Nc2c1cc1c(N(C3CC3)C=C(C1=O)C(O)=O)c2F)(CCSC)[H])=O |
| SPLASH |
splash10-0007-0079000000-53d58cc87cf365e9eafe |
| Source of Spectrum |
EP1721898B1 |
| Wiley ID |
1861533 |
![(S)-6-Cyclopropyl-5-fluoro-3-(2-methylsulfanylethyl)-2,9-dioxo-1,2,3,4,6,9-hexahydropyrido[2,3-g]quinoxaline-8-carboxylic acid](/api/spectrum/3mFn9Qwcgt9/structure.png?h=300&w=458 "(S)-6-Cyclopropyl-5-fluoro-3-(2-methylsulfanylethyl)-2,9-dioxo-1,2,3,4,6,9-hexahydropyrido[2,3-g]quinoxaline-8-carboxylic acid")
