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3,4,5-Trimethyl-2-(3'-methyl-2'-pyridyl)phenyl trifluoromethanesulfonate
SpectraBase Compound ID C6bEHlYBgI1
InChI InChI=1S/C16H16F3NO3S/c1-9-6-5-7-20-15(9)14-12(4)11(3)10(2)8-13(14)23-24(21,22)16(17,18)19/h5-8H,1-4H3
InChIKey BNMYSYQCLJWKPI-UHFFFAOYSA-N
Mol Weight 359.36 g/mol
Molecular Formula C16H16F3NO3S
Exact Mass 359.080299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IcZNDoTidKp
Name 3,4,5-Trimethyl-2-(3'-methyl-2'-pyridyl)phenyl trifluoromethanesulfonate
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Formula C16H16F3NO3S
InChI InChI=1S/C16H16F3NO3S/c1-9-6-5-7-20-15(9)14-12(4)11(3)10(2)8-13(14)23-24(21,22)16(17,18)19/h5-8H,1-4H3
InChIKey BNMYSYQCLJWKPI-UHFFFAOYSA-N
Molecular Weight 359.363 g/mol
SMILES C(S(Oc1c(c(C)c(c(c1)C)C)-c1ncccc1C)(=O)=O)(F)(F)F
SPLASH splash10-03fu-0196000000-3bdece653453802510ac
Source of Spectrum F-56-8897-10
Synonyms 3,4,5-trimethyl-2-(3-methyl-2-pyridinyl)phenyl trifluoromethanesulfonate
Wiley ID 859265