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5F-AKB48
SpectraBase Compound ID G6ZnxoUqcnJ
InChI InChI=1S/C23H30FN3O/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 UCMFSGVIEPXYIV-BRGRSMLUSA-N
Mol Weight 383.51 g/mol
Molecular Formula C23H30FN3O
Exact Mass 383.237291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Zx0djH8GO
Name 5-Fluoro-AKB-48
CAS Registry Number 1400742-13-3
Classification Cannabinoid
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 383.237290760 u
Formula C23H30N3OF
InChI InChI=1S/C23H30FN3O/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 UCMFSGVIEPXYIV-BRGRSMLUSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 383.511 g/mol
SMILES c1cc2c(cc1)[n](nc2C(NC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])=O)CCCCCF
SPLASH splash10-001i-5975000000-d11a1c4537772cacba3f
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_9656