| SpectraBase Spectrum ID |
GXOS4AbStay |
| Name |
Lercanidipine-A 3 |
| Classification |
Pharmaceutical drug artifact |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
595.268235917 u |
| Formula |
C35H37N3O6 |
| InChI |
InChI=1S/C35H37N3O6/c1-23-30(33(39)40)32(27-17-12-18-28(21-27)38(42)43)31(24(2)36-23)34(41)44-35(3,4)22-37(5)20-19-29(25-13-8-6-9-14-25)26-15-10-7-11-16-26/h6-18,21,29H,19-20,22H2,1-5H3,(H,39,40) |
| InChIKey |
XJPFRTCYDMQXMM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
595.696 g/mol |
| Nominal Mass |
595 u |
| Quality |
954 |
| Retention Index |
4621 |
| SMILES |
OC(C1=C(C(=C(N=C1C)C)C(OC(CN(CCC(C=1C=CC=CC1)C1=CC=CC=C1)C)(C)C)=O)C1=CC(=CC=C1)[N+](=O)[O-])=O |
| SPLASH |
splash10-000b-9770000000-1ff88d5740367fe8e246 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,6-Dimethyl-5-[2-[N-(3,3-diphenylpropyl)-N-methylamino]-1,1-dimethyl]ethoxycarbonyl-4-\r(3-nitrophenyl)-3-pyridincarboxylic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001816 |
