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

*Links on SpectraBase are not permalinks.
3-(4-Bromomethylphenyl)-6-phenyl-1,2,4,5-tetrazine
SpectraBase Compound ID 342GgipZsHb
InChI InChI=1S/C15H11BrN4/c16-10-11-6-8-13(9-7-11)15-19-17-14(18-20-15)12-4-2-1-3-5-12/h1-9H,10H2
InChIKey JEZFQUBVHBYHCH-UHFFFAOYSA-N
Mol Weight 327.19 g/mol
Molecular Formula C15H11BrN4
Exact Mass 326.016709 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 1tdvUnkYsL5
Name 3-(4-Bromomethylphenyl)-6-phenyl-1,2,4,5-tetrazine
Appearance Pink raw product
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11BrN4
InChI InChI=1S/C15H11BrN4/c16-10-11-6-8-13(9-7-11)15-19-17-14(18-20-15)12-4-2-1-3-5-12/h1-9H,10H2
InChIKey JEZFQUBVHBYHCH-UHFFFAOYSA-N
Instrument Name Thermo Finnigan MAT 95 XL
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.3
Molecular Weight 327.185 g/mol
Reported Formula C15H11BrN4
SMILES c1(nnc(nn1)-c1ccccc1)-c1ccc(cc1)CBr
SPLASH splash10-014i-0900000000-3618e735dc6ba425202e
Source of Spectrum BJO-15-40-9
Thin-Layer Chromatography Rf = 0.1 (cyclohexane/ethyl acetate, 10:0.25)
Wiley ID 1845909