| SpectraBase Spectrum ID |
3XZKX8JbsG |
| Name |
Nitrendipine |
| CAS Registry Number |
39562-70-4 |
| Classification |
Pharmaceutical drug, coronary vasodilator |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
360.132136366 u |
| Formula |
C18H20N2O6 |
| InChI |
InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3 |
| InChIKey |
PVHUJELLJLJGLN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
360.366 g/mol |
| Nominal Mass |
360 u |
| Quality |
981 |
| Retention Index |
2789 |
| SMILES |
C1(C(=C(NC(=C1C(OC)=O)C)C)C(OCC)=O)C1=CC(=CC=C1)[N+](=O)[O-] |
| SPLASH |
splash10-000i-0391000000-b245eed34ca5e61b87de |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methylethyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029782 |
