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3-PERFLUOROOCTYL-5-METHYL-1,2,4-TRIAZOLE
SpectraBase Compound ID GePlMprvQTf
InChI InChI=1S/C11H4F17N3/c1-2-29-3(31-30-2)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)28/h1H3,(H,29,30,31)
InChIKey QIVGTYHMRCZPQV-UHFFFAOYSA-N
Mol Weight 501.15 g/mol
Molecular Formula C11H4F17N3
Exact Mass 501.013376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38xkDI837ok
Name 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-5-methyl-1H-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H4F17N3
InChI InChI=1S/C11H4F17N3/c1-2-29-3(31-30-2)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)28/h1H3,(H,29,30,31)
InChIKey QIVGTYHMRCZPQV-UHFFFAOYSA-N
Molecular Weight 501.147 g/mol
SMILES [nH]1c(nc(n1)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C
SPLASH splash10-001l-5900000000-e554be952fae2ab5a711
Source of Spectrum F-69-1399-2
Wiley ID 1594727