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Benazepril 2et @P1635

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Benazepril 2et @P1635
SpectraBase Compound ID HEfdiP1PTMU
InChI InChI=1S/C28H36N2O5/c1-4-29(25(28(33)35-6-3)18-16-21-12-8-7-9-13-21)24-19-17-22-14-10-11-15-23(22)30(27(24)32)20-26(31)34-5-2/h7-15,24-25H,4-6,16-20H2,1-3H3
InChIKey LICKLYVWEGSTMZ-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C28H36N2O5
Exact Mass 480.262422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LpdEPz7ECWP
Name Benazepril 2et @P1635
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 480.262422262 u
Formula C28H36N2O5
InChI InChI=1S/C28H36N2O5/c1-4-29(25(28(33)35-6-3)18-16-21-12-8-7-9-13-21)24-19-17-22-14-10-11-15-23(22)30(27(24)32)20-26(31)34-5-2/h7-15,24-25H,4-6,16-20H2,1-3H3
InChIKey LICKLYVWEGSTMZ-UHFFFAOYSA-N
Molecular Weight 480.605 g/mol
SMILES C=1C=CC(CCC(N(C2C(N(C3=C(CC2)C=CC=C3)CC(=O)OCC)=O)CC)C(=O)OCC)=CC1