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Hydroxy Acetildenafil TMS
SpectraBase Compound ID Cwp9iGc1WdU
InChI InChI=1S/C28H42N6O4Si/c1-7-9-22-25-26(32(3)31-22)28(36)30-27(29-25)21-18-20(10-11-24(21)37-8-2)23(35)19-34-14-12-33(13-15-34)16-17-38-39(4,5)6/h10-11,18H,7-9,12-17,19H2,1-6H3,(H,29,30,36)
InChIKey XKKSEPXUMCIKAA-UHFFFAOYSA-N
Mol Weight 554.8 g/mol
Molecular Formula C28H42N6O4Si
Exact Mass 554.30368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH270OYVGnw
Name Hydroxyacetildenafil TMS
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 554.303680387 u
Formula C28H42N6O4Si
InChI InChI=1S/C28H42N6O4Si/c1-7-9-22-25-26(32(3)31-22)28(36)30-27(29-25)21-18-20(10-11-24(21)37-8-2)23(35)19-34-14-12-33(13-15-34)16-17-38-39(4,5)6/h10-11,18H,7-9,12-17,19H2,1-6H3,(H,29,30,36)
InChIKey XKKSEPXUMCIKAA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 554.767 g/mol
Nominal Mass 554 u
Quality 986
Retention Index 3600
SMILES C12=C(N=C(C=3C(=CC=C(C3)C(CN3CCN(CC3)CCO[Si](C)(C)C)=O)OCC)NC2=O)C(=NN1C)CCC
SPLASH splash10-014i-5391100000-8de3d05e4c0c9b582ed5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Hydroxy Acetildenafil TMS Hydroxyhongdenafil TMS 5-(2-ethoxy-5-((4-(2-((trimethylsilyl)oxy)ethyl)piperazin-1-yl)acetyl)phenyl)-1-methyl-3-propyl-1,6-\rdihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Technique GC/MS
Wiley ID DD2024_017972