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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)

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SpectraBase Spectrum ID 8FRDqskvaAi
Name 5F-ABICA-A (-H2O) TMS I
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 967
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 splash10-001i-1492100000-67993c2863618115b152
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_019188