For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5F-ABICA-A (-H2O) TMS II
SpectraBase Compound ID JbEtu6GEzLE
InChI InChI=1S/C22H32FN3OSi/c1-17(2)20(15-24)25-22(27-28(3,4)5)19-16-26(14-10-6-9-13-23)21-12-8-7-11-18(19)21/h7-8,11-12,15-16,24H,6,9-10,13-14H2,1-5H3/b24-15+,25-22-
InChIKey XQDFAYSZHLQKOR-JZIGQTSASA-N
Mol Weight 401.6 g/mol
Molecular Formula C22H32FN3OSi
Exact Mass 401.229867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2obZp8yXKiG
Name 5F-ABICA-A (-H2O) TMS II
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 401.229867359 u
Formula C22H32FN3OSi
InChI InChI=1S/C22H32FN3OSi/c1-17(2)20(15-24)25-22(27-28(3,4)5)19-16-26(14-10-6-9-13-23)21-12-8-7-11-18(19)21/h7-8,11-12,15-16,24H,6,9-10,13-14H2,1-5H3/b24-15+,25-22-
InChIKey XQDFAYSZHLQKOR-JZIGQTSASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 401.601 g/mol
Nominal Mass 401 u
Quality 998
Retention Index 3072
SMILES C=1(C=2C(N(C1)CCCCCF)=CC=CC2)\C(=N\C(=C(C)C)C=N)O[Si](C)(C)C
SPLASH splash10-000i-1219200000-7f26f615ac7a1f834d72
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms trimethylsilyl 1-(5-fluoropentyl)-N-(1-imino-3-methylbut-2-en-2-yl)-1H-indole-3-carboximidate
Technique GC/MS
Wiley ID DD2024_019189