| SpectraBase Spectrum ID |
3aXkdseo3N2 |
| Name |
(4S)-4-[(1R)-1-(benzenesulfonyl)-2-methyl-propyl]-3-nitro-1,4-dihydropyridine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.098728238 u |
| Formula |
C15H18N2O4S |
| InChI |
InChI=1S/C15H18N2O4S/c1-11(2)15(13-8-9-16-10-14(13)17(18)19)22(20,21)12-6-4-3-5-7-12/h3-11,13,15-16H,1-2H3/t13-,15+/m0/s1 |
| InChIKey |
YYCVUUVQZTUTIG-DZGCQCFKSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202201153 |
| Molecular Weight |
322.379 g/mol |
| Quality |
77 |
| Reported Formula |
C15H18N2O4S |
| SMILES |
N1C=C[C@@](C(=C1)[N+]([O-])=O)([C@@](C(C)C)(S(C1=CC=CC=C1)(=O)=O)[H])[H] |
| SPLASH |
splash10-004i-0900000000-340bcb9eaa66d24a496b |
| Source of Spectrum |
QE-28-SM27-2c (DOI: 10.1002/chem.202201153) |
| Wiley ID |
1900578 |
![(4S)-4-[(1R)-1-(benzenesulfonyl)-2-methyl-propyl]-3-nitro-1,4-dihydropyridine](/api/spectrum/3aXkdseo3N2/structure.png?h=300&w=458 "(4S)-4-[(1R)-1-(benzenesulfonyl)-2-methyl-propyl]-3-nitro-1,4-dihydropyridine")
