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Ethaverine
SpectraBase Compound ID IGWudT0VTBV
InChI InChI=1S/C24H29NO4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20/h9-12,14-16H,5-8,13H2,1-4H3
InChIKey ZOWYFYXTIWQBEP-UHFFFAOYSA-N
Mol Weight 395.5 g/mol
Molecular Formula C24H29NO4
Exact Mass 395.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HgkiFVVujY
Name Ethaverine
CAS Registry Number 486-47-5
Classification Pharmaceutical drug, spasmolytic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 395.209658414 u
Formula C24H29NO4
InChI InChI=1S/C24H29NO4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20/h9-12,14-16H,5-8,13H2,1-4H3
InChIKey ZOWYFYXTIWQBEP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 395.499 g/mol
Nominal Mass 395 u
Quality 953
Retention Index 2926
SMILES C1=2C(=CC(=C(C2)OCC)OCC)C=CN=C1CC1=CC(=C(C=C1)OCC)OCC
SPLASH splash10-014m-0129000000-b641b4c1b9e7b2338abf
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Perparine 1-[(3,4-Diethoxyphenyl)methyl]-6,7-diethoxy-isoquinoline
Technique GC/MS
Wiley ID DD2024_001343