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Denaverine
SpectraBase Compound ID BLbtcE1H3Sr
InChI InChI=1S/C24H33NO3/c1-5-20(6-2)19-28-24(21-13-9-7-10-14-21,22-15-11-8-12-16-22)23(26)27-18-17-25(3)4/h7-16,20H,5-6,17-19H2,1-4H3
InChIKey FPTOUQZVCUIPHY-UHFFFAOYSA-N
Mol Weight 383.5 g/mol
Molecular Formula C24H33NO3
Exact Mass 383.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DdvBsE218MM
Name Denaverine
CAS Registry Number 3579-62-2
Classification Pharmaceutical drug, spasmolytic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 383.246043924 u
Formula C24H33NO3
InChI InChI=1S/C24H33NO3/c1-5-20(6-2)19-28-24(21-13-9-7-10-14-21,22-15-11-8-12-16-22)23(26)27-18-17-25(3)4/h7-16,20H,5-6,17-19H2,1-4H3
InChIKey FPTOUQZVCUIPHY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 383.532 g/mol
Nominal Mass 383 u
Quality 925
Retention Index 2873
SMILES C(C=1C=CC=CC1)(C1=CC=CC=C1)(C(OCCN(C)C)=O)OCC(CC)CC
SPLASH splash10-0ac0-9720000000-2c5e6e9fcb46dc540f14
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-Dimethylaminoethyl-2-(2-ethylbutoxy)-2,2-diphenyl acetate
Technique GC/MS
Wiley ID DD2024_006280