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5-[3,5-Bis(trifluoromethyl)phenyl]-2H-tetraazole
SpectraBase Compound ID E5jR6b0CIel
InChI InChI=1S/C9H4F6N4/c10-8(11,12)5-1-4(7-16-18-19-17-7)2-6(3-5)9(13,14)15/h1-3H,(H,16,17,18,19)
InChIKey KKJFZIQEWZVVIV-UHFFFAOYSA-N
Mol Weight 282.15 g/mol
Molecular Formula C9H4F6N4
Exact Mass 282.034015 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AVrsiKlP72
Name 5-[3,5-Bis(trifluoromethyl)phenyl]-2H-tetraazole
Alternate Name(s) 2H-Tetrazole, 5-[3,5-bis(trifluoromethyl)phenyl]- 5-[3,5-bis(trifluoromethyl)phenyl]-2H-1,2,3,4-tetrazole 5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole
CAS Registry Number 175205-09-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4F6N4
InChI InChI=1S/C9H4F6N4/c10-8(11,12)5-1-4(7-16-18-19-17-7)2-6(3-5)9(13,14)15/h1-3H,(H,16,17,18,19)
InChIKey KKJFZIQEWZVVIV-UHFFFAOYSA-N
Molecular Weight 282.149 g/mol
SMILES [nH]1nnc(n1)-c1cc(C(F)(F)F)cc(C(F)(F)F)c1
SPLASH splash10-0udi-5890000000-33794c2bd837b0f0d9c2
Source of Spectrum AD-0-2532-0
Wiley ID 1421264