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Pentoxyfylline TMS
SpectraBase Compound ID GwwFvt7EHyB
InChI InChI=1S/C16H26N4O3Si/c1-12(23-24(4,5)6)9-7-8-10-20-15(21)13-14(17-11-18(13)2)19(3)16(20)22/h11H,1,7-10H2,2-6H3
InChIKey PUOJFKNLPFWNDY-UHFFFAOYSA-N
Mol Weight 350.49 g/mol
Molecular Formula C16H26N4O3Si
Exact Mass 350.177417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjUNWZk8bjQ
Name Pentoxyfylline TMS
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 350.177417245 u
Formula C16H26N4O3Si
InChI InChI=1S/C16H26N4O3Si/c1-12(23-24(4,5)6)9-7-8-10-20-15(21)13-14(17-11-18(13)2)19(3)16(20)22/h11H,1,7-10H2,2-6H3
InChIKey PUOJFKNLPFWNDY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 350.494 g/mol
Nominal Mass 350 u
Quality 981
Retention Index 2767
SMILES C12=C(N(C(N(C2=O)CCCCC(O[Si](C)(C)C)=C)=O)C)N=CN1C
SPLASH splash10-00ec-4950000000-fd8695a2fdccd2a886ab
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3,7-dimethyl-1-(5-((trimethylsilyl)oxy)hex-5-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Technique GC/MS
Wiley ID DD2024_034451