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5-Iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-[1,2,3]triazol-4-ylmethyl 5-Iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-[1,2,3]triazol-4-carboxylate

View entire compound with spectra: 1 MS (GC)

5-Iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-[1,2,3]triazol-4-ylmethyl 5-Iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-[1,2,3]triazol-4-carboxylate
SpectraBase Compound ID 9VMw5NTOofJ
InChI InChI=1S/C12H8F8I2N6O2/c13-9(14)11(17,18)2-27-6(21)4(23-25-27)1-30-8(29)5-7(22)28(26-24-5)3-12(19,20)10(15)16/h9-10H,1-3H2
InChIKey GTEVQNLOWGQCIZ-UHFFFAOYSA-N
Mol Weight 674.03 g/mol
Molecular Formula C12H8F8I2N6O2
Exact Mass 673.867039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CaIKy3y8Kb2
Name 5-Iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-[1,2,3]triazol-4-ylmethyl 5-Iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-[1,2,3]triazol-4-carboxylate
Alternate Name(s) [5-iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-1,2,3-triazol-4-yl]methyl 5-iodo-1-(2,2,3,3-tetrafluoropropyl)-1H-1,2,3-triazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8F8I2N6O2
InChI InChI=1S/C12H8F8I2N6O2/c13-9(14)11(17,18)2-27-6(21)4(23-25-27)1-30-8(29)5-7(22)28(26-24-5)3-12(19,20)10(15)16/h9-10H,1-3H2
InChIKey GTEVQNLOWGQCIZ-UHFFFAOYSA-N
Molecular Weight 674.032 g/mol
SMILES c1([n](nnc1C(OCc1c([n](CC(C(F)F)(F)F)nn1)I)=O)CC(C(F)F)(F)F)I
SPLASH splash10-100u-9446000000-e3b507be1138dbd1b35b
Source of Spectrum CV-2005-1317-5
Wiley ID 1611707