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4-(Trifluoromethyl)coumarin-7-O-sulphamate
SpectraBase Compound ID BSppTAuTM0y
InChI InChI=1S/C10H6F3NO5S/c11-10(12,13)7-4-9(15)18-8-3-5(1-2-6(7)8)19-20(14,16)17/h1-4H,(H2,14,16,17)
InChIKey XMGXBRWARBTDGF-UHFFFAOYSA-N
Mol Weight 309.22 g/mol
Molecular Formula C10H6F3NO5S
Exact Mass 308.991878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QMnjKSzgUb
Name 4-(trifluoromethyl)coumarin 7-O-sulfamate
Alternate Name(s) sulfamic acid [2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl] ester [2-oxo-4-(trifluoromethyl)chromen-7-yl] sulfamate [2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl] sulfamate
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Formula C10H6F3NO5S
InChI InChI=1S/C10H6F3NO5S/c11-10(12,13)7-4-9(15)18-8-3-5(1-2-6(7)8)19-20(14,16)17/h1-4H,(H2,14,16,17)
InChIKey XMGXBRWARBTDGF-UHFFFAOYSA-N
Molecular Weight 309.215 g/mol
SMILES NS(Oc1ccc2c(c1)OC(C=C2C(F)(F)F)=O)(=O)=O
SPLASH splash10-0ue9-0090000000-a921ad11cb52c4a1d022
Source of Spectrum F2-41-1078-16
Wiley ID 1599503