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APINACA (5-chloropentyl) TMS
SpectraBase Compound ID LsnnqC9rrP8
InChI InChI=1S/C26H38ClN3OSi/c1-32(2,3)30(26-16-19-13-20(17-26)15-21(14-19)18-26)25(31)24-22-9-5-6-10-23(22)29(28-24)12-8-4-7-11-27/h5-6,9-10,19-21H,4,7-8,11-18H2,1-3H3/t19-,20+,21-,26-
InChIKey JGBAXKQOEGXVMA-AFJPGINASA-N
Mol Weight 472.1 g/mol
Molecular Formula C26H38ClN3OSi
Exact Mass 471.247267 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJZHZ9Nq8Wm
Name APINACA (5-chloropentyl) TMS
Classification Indazole cannabinoid designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 471.247267090 u
Formula C26H38ClN3OSi
InChI InChI=1S/C26H38ClN3OSi/c1-32(2,3)30(26-16-19-13-20(17-26)15-21(14-19)18-26)25(31)24-22-9-5-6-10-23(22)29(28-24)12-8-4-7-11-27/h5-6,9-10,19-21H,4,7-8,11-18H2,1-3H3/t19-,20+,21-,26-
InChIKey JGBAXKQOEGXVMA-AFJPGINASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 472.148 g/mol
Nominal Mass 471 u
Quality 896
Retention Index 3657
SMILES C12(N(C(C=3C=4C(N(N3)CCCCCCl)=CC=CC4)=O)[Si](C)(C)C)C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-00xv-3597100000-867d86d652a3e5d4f5be
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5Cl-AKB-48 TMS 5Cl-AKB48 TMS 5-Cl-APINACA TMS 1-(5-chloropentyl)-N-(tricyclo[3.3.1.1^(3,7)]dec-1-yl)-N-(trimethylsilyl)-1H-indazole-3-carboxamide
Technique GC/MS
Wiley ID DD2024_021935