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2-(5,7-Di-tert-butyl-benzo[1,3]oxathiol-2-ylidene)-3,3,3-trifluoro-propionic acid methyl ester
SpectraBase Compound ID 51thOFBwIdw
InChI InChI=1S/C19H23F3O3S/c1-17(2,3)10-8-11(18(4,5)6)14-12(9-10)26-16(25-14)13(15(23)24-7)19(20,21)22/h8-9H,1-7H3/b16-13+
InChIKey JTBIHDONBHGXEY-DTQAZKPQSA-N
Mol Weight 388.45 g/mol
Molecular Formula C19H23F3O3S
Exact Mass 388.132 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1C65rges4Ef
Name 2-(5,7-Di-tert-butyl-benzo[1,3]oxathiol-2-ylidene)-3,3,3-trifluoro-propionic acid methyl ester
Alternate Name(s) (2E)-2-(5,7-ditert-butyl-1,3-benzoxathiol-2-ylidene)-3,3,3-trifluoro-propionic acid methyl ester (2E)-2-(5,7-ditert-butyl-1,3-benzoxathiol-2-ylidene)-3,3,3-trifluoropropanoic acid methyl ester Methyl (2E)-2-(5,7-ditert-butyl-1,3-benzoxathiol-2-ylidene)-3,3,3-trifluoro-propanoate Methyl (2E)-2-(5,7-ditert-butyl-1,3-benzoxathiol-2-ylidene)-3,3,3-tris(fluoranyl)propanoate Methyl 2-(5,7-ditert-butyl-1,3-benzoxathiol-2-ylidene)-3,3,3-trifluoropropanoate
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Formula C19H23F3O3S
InChI InChI=1S/C19H23F3O3S/c1-17(2,3)10-8-11(18(4,5)6)14-12(9-10)26-16(25-14)13(15(23)24-7)19(20,21)22/h8-9H,1-7H3/b16-13+
InChIKey JTBIHDONBHGXEY-DTQAZKPQSA-N
Molecular Weight 388.445 g/mol
SMILES COC(\C(=C/1Sc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C)C(F)(F)F)=O
SPLASH splash10-00dr-2319000000-d05c56140d57d4d0b791
Wiley ID 1463109