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2-Allyl-4-(hydroxymethyl)-6-methoxyphenyl Trifluoromethanesulfonate
SpectraBase Compound ID IA02HieFvzT
InChI InChI=1S/C12H13F3O5S/c1-3-4-9-5-8(7-16)6-10(19-2)11(9)20-21(17,18)12(13,14)15/h3,5-6,16H,1,4,7H2,2H3
InChIKey YROLASJVQNDBTO-UHFFFAOYSA-N
Mol Weight 326.29 g/mol
Molecular Formula C12H13F3O5S
Exact Mass 326.043579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35Pz1jOZFBM
Name 2-Allyl-4-(hydroxymethyl)-6-methoxyphenyl Trifluoromethanesulfonate
CAS Registry Number 137898-18-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13F3O5S
InChI InChI=1S/C12H13F3O5S/c1-3-4-9-5-8(7-16)6-10(19-2)11(9)20-21(17,18)12(13,14)15/h3,5-6,16H,1,4,7H2,2H3
InChIKey YROLASJVQNDBTO-UHFFFAOYSA-N
Molecular Weight 326.286 g/mol
SMILES OCc1cc(c(OS(C(F)(F)F)(=O)=O)c(c1)OC)CC=C
SPLASH splash10-002f-3900000000-40c8115e9d99477b1bc6
Source of Spectrum J-57-684-28
Wiley ID 1324368