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6-Trifluoromethylsulfonyl-3-phenylthio-(2,3,4H)-furo(2,3-H)-1-benzopyran
SpectraBase Compound ID EhGkDIQFKil
InChI InChI=1S/C18H13F3O5S2/c19-18(20,21)28(22,23)26-15-9-11-8-13(27-12-4-2-1-3-5-12)10-25-16(11)14-6-7-24-17(14)15/h1-7,9,13H,8,10H2
InChIKey JIQQSHFSZRAXSB-UHFFFAOYSA-N
Mol Weight 430.41 g/mol
Molecular Formula C18H13F3O5S2
Exact Mass 430.01565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3sWbTsMUzg
Name 2H-Furo[2,3-h]-1-benzopyran, methanesulfonic acid deriv.
Alternate Name(s) Methanesulfonic acid, trifluoro-, 3,4-dihydro-3-(phenylthio)-2H-furo[2,3-h]-1-benzopyran-6-yl ester 3-(Phenylsulfanyl)-3,4-dihydro-2H-furo[2,3-h]chromen-6-yl trifluoromethanesulfonate 6-[(trifluoromethyl)sulfonyl]-3-(phenylthio)-(2,3,4H)-furo[2,3-h]-benzopyran
CAS Registry Number 112183-05-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3O5S2
InChI InChI=1S/C18H13F3O5S2/c19-18(20,21)28(22,23)26-15-9-11-8-13(27-12-4-2-1-3-5-12)10-25-16(11)14-6-7-24-17(14)15/h1-7,9,13H,8,10H2
InChIKey JIQQSHFSZRAXSB-UHFFFAOYSA-N
Molecular Weight 430.412 g/mol
SMILES C(S(Oc1c2c(cco2)c2c(c1)CC(Sc1ccccc1)CO2)(=O)=O)(F)(F)F
SPLASH splash10-001a-0940400000-39a98d95876bf2f07503
Source of Spectrum C-110-7433-73
Wiley ID 1381373