SpectraBase Spectrum ID |
ITvQamiuUo0 |
Name |
Lisinopril 4me |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
461.288971363 u |
Formula |
C25H39N3O5 |
InChI |
InChI=1S/C25H39N3O5/c1-27(2)17-9-8-13-20(23(29)28-18-10-14-22(28)25(31)33-4)26-21(24(30)32-3)16-15-19-11-6-5-7-12-19/h5-7,11-12,20-22,26H,8-10,13-18H2,1-4H3 |
InChIKey |
FMJJCRUFOFEWOC-UHFFFAOYSA-N |
Molecular Weight |
461.603 g/mol |
SMILES |
C(N1C(C(OC)=O)CCC1)(C(NC(C(OC)=O)CCC=1C=CC=CC1)CCCCN(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.869908 |