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 |