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3-[4-(Trifluoromethyl)phenyl]-6-(4-chlorobenzyl)-1,2,4,5-tetrazine
SpectraBase Compound ID 2xfTHaSP3Wk
InChI InChI=1S/C16H10ClF3N4/c17-13-7-1-10(2-8-13)9-14-21-23-15(24-22-14)11-3-5-12(6-4-11)16(18,19)20/h1-8H,9H2
InChIKey JWXGUOPDAFWGHT-UHFFFAOYSA-N
Mol Weight 350.73 g/mol
Molecular Formula C16H10ClF3N4
Exact Mass 350.054609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8slo69btgLu
Name 3-[4-(Trifluoromethyl)phenyl]-6-(4-chlorobenzyl)-1,2,4,5-tetrazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10ClF3N4
InChI InChI=1S/C16H10ClF3N4/c17-13-7-1-10(2-8-13)9-14-21-23-15(24-22-14)11-3-5-12(6-4-11)16(18,19)20/h1-8H,9H2
InChIKey JWXGUOPDAFWGHT-UHFFFAOYSA-N
Molecular Weight 350.732 g/mol
SMILES c1(nnc(nn1)Cc1ccc(cc1)Cl)-c1ccc(C(F)(F)F)cc1
SPLASH splash10-01b9-1900000000-ee7b29a5061ba747fd95
Source of Spectrum Y-45-1749-10f
Synonyms 3-[(4-chlorophenyl)methyl]-6-[4-(trifluoromethyl)phenyl]-1,2,4,5-tetrazine
Wiley ID 1666601