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3,4,8-Trimethylcoumarin-7-O-sulphamate

View entire compound with spectra: 2 MS (GC)

3,4,8-Trimethylcoumarin-7-O-sulphamate
SpectraBase Compound ID AVQPywd1QQ7
InChI InChI=1S/C12H13NO5S/c1-6-7(2)12(14)17-11-8(3)10(5-4-9(6)11)18-19(13,15)16/h4-5H,1-3H3,(H2,13,15,16)
InChIKey MGLHKQSJDMGFMJ-UHFFFAOYSA-N
Mol Weight 283.3 g/mol
Molecular Formula C12H13NO5S
Exact Mass 283.051444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeGd596O2BY
Name 3,4,8-(Trimethyl)coumarin 7-O-sulfamate
Alternate Name(s) sulfamic acid (3,4,8-trimethyl-2-oxo-1-benzopyran-7-yl) ester (3,4,8-trimethyl-2-oxochromen-7-yl) sulfamate (3,4,8-trimethyl-2-oxo-chromen-7-yl) sulfamate (3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl) sulfamate
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Formula C12H13NO5S
InChI InChI=1S/C12H13NO5S/c1-6-7(2)12(14)17-11-8(3)10(5-4-9(6)11)18-19(13,15)16/h4-5H,1-3H3,(H2,13,15,16)
InChIKey MGLHKQSJDMGFMJ-UHFFFAOYSA-N
Molecular Weight 283.298 g/mol
SMILES NS(Oc1c(c2OC(=O)C(=C(c2cc1)C)C)C)(=O)=O
SPLASH splash10-0006-9050000000-aca17b4a430210275bd8
Source of Spectrum F2-41-1078-18
Wiley ID 1599502