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5I-AKB-48
SpectraBase Compound ID 1aNjOYsUgjn
InChI InChI=1S/C23H30IN3O/c24-8-4-1-5-9-27-20-7-3-2-6-19(20)21(26-27)22(28)25-23-13-16-10-17(14-23)12-18(11-16)15-23/h2-3,6-7,16-18H,1,4-5,8-15H2,(H,25,28)/t16-,17+,18-,23-
InChIKey MFCCWXHEBPXOLS-BRGRSMLUSA-N
Mol Weight 491.42 g/mol
Molecular Formula C23H30IN3O
Exact Mass 491.143358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oHhQB511Ky
Name 5I-AKB-48
Classification Indazole cannabinoid designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 491.143357597 u
Formula C23H30IN3O
InChI InChI=1S/C23H30IN3O/c24-8-4-1-5-9-27-20-7-3-2-6-19(20)21(26-27)22(28)25-23-13-16-10-17(14-23)12-18(11-16)15-23/h2-3,6-7,16-18H,1,4-5,8-15H2,(H,25,28)/t16-,17+,18-,23-
InChIKey MFCCWXHEBPXOLS-BRGRSMLUSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 491.417 g/mol
Nominal Mass 491 u
Quality 963
Retention Index 3589
SMILES C12(NC(C=3C=4C(N(N3)CCCCCI)=CC=CC4)=O)C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-01qc-3963500000-cd5695cc9071cd18279c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-Adamantyl)-1-(5-iodopentyl)indazole-3-carboxamide
Technique GC/MS
Wiley ID DD2024_021054