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

*Links on SpectraBase are not permalinks.
1C-B N-(3-fluorobenzyl)
SpectraBase Compound ID Arj3cIQQFb
InChI InChI=1S/C16H17BrFNO2/c1-20-15-8-14(17)16(21-2)7-12(15)10-19-9-11-4-3-5-13(18)6-11/h3-8,19H,9-10H2,1-2H3
InChIKey AUEFEZQUQTUGRI-UHFFFAOYSA-N
Mol Weight 354.22 g/mol
Molecular Formula C16H17BrFNO2
Exact Mass 353.04267 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 JIGHvepAa7U
Name 1C-B N-(3-fluorobenzyl)
Classification Designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 353.042669952 u
Formula C16H17BrFNO2
InChI InChI=1S/C16H17BrFNO2/c1-20-15-8-14(17)16(21-2)7-12(15)10-19-9-11-4-3-5-13(18)6-11/h3-8,19H,9-10H2,1-2H3
InChIKey AUEFEZQUQTUGRI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 354.219 g/mol
Nominal Mass 353 u
Quality 917
Retention Index 2480
SMILES C1(=C(C=C(C(=C1)OC)Br)OC)CNCC=1C=C(C=CC1)F
SPLASH splash10-0ac0-2952000000-eeccba69814cc23875c0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-3-Fluorobenzyl-4-bromo-2,5-dimethoxybenzylamine 1-(4-Bromo-2,5-dimethoxyphenyl)-N-(3-fluorobenzyl)methanamine
Technique GC/MS
Wiley ID DD2024_020041