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Desmethylcarbodenafil-A
SpectraBase Compound ID 4jX09JGEPxz
InChI InChI=1S/C20H25N5O3/c1-6-8-14-16-17(25(5)23-14)19(26)22-18(21-16)13-11-12(20(27)24(3)4)9-10-15(13)28-7-2/h9-11H,6-8H2,1-5H3,(H,21,22,26)
InChIKey QFSFOYCDSJRMAK-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C20H25N5O3
Exact Mass 383.19574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2JvEDGS8G
Name Desmethylcarbodenafil-A
Classification Drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 383.195739682 u
Formula C20H25N5O3
InChI InChI=1S/C20H25N5O3/c1-6-8-14-16-17(25(5)23-14)19(26)22-18(21-16)13-11-12(20(27)24(3)4)9-10-15(13)28-7-2/h9-11H,6-8H2,1-5H3,(H,21,22,26)
InChIKey QFSFOYCDSJRMAK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 383.452 g/mol
Nominal Mass 383 u
Quality 915
Retention Index 3168
SMILES C12=C(N=C(C=3C(=CC=C(C3)C(N(C)C)=O)OCC)NC1=O)C(=NN2C)CCC
SPLASH splash10-02ai-2659000000-06be588b87672d0612a9
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-[2-Ethoxy-5-(N,N-dimethylaminocarbonyl)phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-\r7-one 4-ethoxy-N,N-dimethyl-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)benzamide
Technique GC/MS
Wiley ID DD2024_023500