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Substance Name: Thiopyrylium, 2,6-bis(1,1-dimethylethyl)-4-methyl-, 1,1,1-trifluoromethanesulfonate (1:1)
RN: 125109-86-6
InChIKey: HRMYDRKEDPGFSV-UHFFFAOYSA-M

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C14-H23-S.C-F3-O3-S

Molecular Weight

  • 372.4697
 
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Names and Synonyms

  • Thiopyrylium, 2,6-bis(1,1-dimethylethyl)-4-methyl-, 1,1,1-trifluoromethanesulfonate (1:1)
  • Thiopyrylium, 2,6-bis(1,1-dimethylethyl)-4-methyl-, salt with trifluoromethanesulfonic acid (1:1)

Registry Numbers

CAS Registry Number

  • 125109-86-6

System Generated Number

  • 0125109866

Molecular Formulas

Molecular Formula

  • C14-H23-S.C-F3-O3-S

Molecular Formula Fragments

  • C-F3-O3-S
  • C14-H23-S
  • COMPONENT

Structure Descriptors

InChI

1S/C14H23S.CHF3O3S/c1-10-8-11(13(2,3)4)15-12(9-10)14(5,6)7;2-1(3,4)8(5,6)7/h8-9H,1-7H3;(H,5,6,7)/q+1;/p-1

InChIKey

HRMYDRKEDPGFSV-UHFFFAOYSA-M

Smiles

S(=O)(=O)(C(F)(F)F)[O-].[s+]1c(C(C)(C)C)cc(cc1C(C)(C)C)C