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Benazepril
SpectraBase Compound ID 6QDdxAxKZ1J
InChI InChI=1S/C24H28N2O5/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28)/t19-,20?/m0/s1
InChIKey XPCFTKFZXHTYIP-XJDOXCRVSA-N
Mol Weight 424.5 g/mol
Molecular Formula C24H28N2O5
Exact Mass 424.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kTDyS84lG4
Name Benazepril
CAS Registry Number 86541-75-5
Classification Pharmaceutical drug, ACE inhibitor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 424.199822005 u
Formula C24H28N2O5
InChI InChI=1S/C24H28N2O5/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28)/t19-,20?/m0/s1
InChIKey XPCFTKFZXHTYIP-XJDOXCRVSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 424.497 g/mol
Nominal Mass 424 u
Quality 940
SMILES OC(CN1C=2C(CC[C@@](C1=O)(NC(C(OCC)=O)CCC=1C=CC=CC1)[H])=CC=CC2)=O
SPLASH splash10-0udl-2914000000-0d0e6163bc12a7eae3b2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Acetic acid,2-[(4s)-4-[[(1S)-1-Ethoxycarbonyl-3-phenyl-propyl]amino]-5-oxo-6-azabicyclo[5.4.0]-\rundeca-7,9,11-trien-6-yl] 2-[(4S)-4-[[(1S)-1-Ethoxycarbonyl-3-phenyl-propyl]amino]-5-oxo-6-azabicyclo[5.4.0]-\rundeca-7,9,11-trien-6-yl]acetic acid
Technique DI/MS
Wiley ID DD2024_006339