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Moxaverine-M (Nor,OH,-H2O) I
SpectraBase Compound ID 6Z0iotHKOSj
InChI InChI=1S/C19H17NO2/c1-3-15-10-14-11-19(22-2)18(21)12-16(14)17(20-15)9-13-7-5-4-6-8-13/h3-8,10-12,21H,1,9H2,2H3
InChIKey UTUVJLWPIWICRA-UHFFFAOYSA-N
Mol Weight 291.35 g/mol
Molecular Formula C19H17NO2
Exact Mass 291.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVhrvDgWQK0
Name Moxaverine-M (Nor,OH,-H2O) I
Classification Pharmaceutical drug metabolite
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 291.125928789 u
Formula C19H17NO2
InChI InChI=1S/C19H17NO2/c1-3-15-10-14-11-19(22-2)18(21)12-16(14)17(20-15)9-13-7-5-4-6-8-13/h3-8,10-12,21H,1,9H2,2H3
InChIKey UTUVJLWPIWICRA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 291.350 g/mol
Nominal Mass 291 u
Quality 894
Retention Index 2274
SMILES OC=1C=C2C(=CC1OC)C=C(N=C2CC1=CC=CC=C1)C=C
SPLASH splash10-004m-0290000000-3834d995a89acd641eff
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-benzyl-3-ethenyl-6-methoxyisoquinolin-7-ol
Technique GC/MS
Wiley ID DD2024_009192