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1-METHYL-2-PHENYL-4H-PYRAZOLO-[1,5-A]-INDOLIUM-TRIFLUORO-METHANESULFONATE
SpectraBase Compound ID 5GfF7eULZ3K
InChI InChI=1S/C17H15N2.CHF3O3S/c1-18-17(13-7-3-2-4-8-13)12-15-11-14-9-5-6-10-16(14)19(15)18;2-1(3,4)8(5,6)7/h2-10,12H,11H2,1H3;(H,5,6,7)/q+1;/p-1
InChIKey NDDJFZKUDUKHCC-UHFFFAOYSA-M
Mol Weight 396.38 g/mol
Molecular Formula C18H15F3N2O3S
Exact Mass 396.075548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7d70QspMpH1
Name 1-Methyl-2-phenyl-1H-pyrazolo[1,5-a]indolium trifluoromethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15F3N2O3S
InChI InChI=1S/C17H15N2.CHF3O3S/c1-18-17(13-7-3-2-4-8-13)12-15-11-14-9-5-6-10-16(14)19(15)18;2-1(3,4)8(5,6)7/h2-10,12H,11H2,1H3;(H,5,6,7)/q+1;/p-1
InChIKey NDDJFZKUDUKHCC-UHFFFAOYSA-M
Molecular Weight 396.384 g/mol
SMILES C(S([O-])(=O)=O)(F)(F)F.c1([n]([n+]-2c(c1)Cc1c2cccc1)C)-c1ccccc1
SPLASH splash10-003r-0490000000-3b76868b0aa15bd2e9de
Source of Spectrum KC-0-1875-28
Wiley ID 781493