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(6-chloranylbenzotriazol-1-yl)-[2,3,4,5,6-pentakis(fluoranyl)phenyl]methanone
SpectraBase Compound ID JGWXKaSUh1d
InChI InChI=1S/C13H3ClF5N3O/c14-4-1-2-5-6(3-4)22(21-20-5)13(23)7-8(15)10(17)12(19)11(18)9(7)16/h1-3H
InChIKey QSSWOFNWSARKBK-UHFFFAOYSA-N
Mol Weight 347.63 g/mol
Molecular Formula C13H3ClF5N3O
Exact Mass 346.98848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7l1GDyJYvnm
Name (6-chloranylbenzotriazol-1-yl)-[2,3,4,5,6-pentakis(fluoranyl)phenyl]methanone
Alternate Name(s) (6-chloro-1-benzotriazolyl)-(2,3,4,5,6-pentafluorophenyl)methanone (6-chlorobenzotriazol-1-yl)-(2,3,4,5,6-pentafluorophenyl)methanone
CAS Registry Number 76884-11-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H3ClF5N3O
InChI InChI=1S/C13H3ClF5N3O/c14-4-1-2-5-6(3-4)22(21-20-5)13(23)7-8(15)10(17)12(19)11(18)9(7)16/h1-3H
InChIKey QSSWOFNWSARKBK-UHFFFAOYSA-N
Molecular Weight 347.632 g/mol
SMILES C([n]1nnc2c1cc(cc2)Cl)(c1c(c(F)c(c(c1F)F)F)F)=O
SPLASH splash10-0002-0905000000-e538c78ff0dd655437df
Source of Spectrum Y-17-1508-0
Wiley ID 1339844