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4-(benzenesulfonyl)-6-bromo-3-spiro[3H-1,4-benzoxazine-2,1'-cyclopropane]carboxylic acid methyl ester
SpectraBase Compound ID J7rGEiz1Q3j
InChI InChI=1S/C18H16BrNO5S/c1-24-17(21)16-18(9-10-18)25-15-8-7-12(19)11-14(15)20(16)26(22,23)13-5-3-2-4-6-13/h2-8,11,16H,9-10H2,1H3
InChIKey FIEHJBILQJBEAS-UHFFFAOYSA-N
Mol Weight 438.29 g/mol
Molecular Formula C18H16BrNO5S
Exact Mass 436.993257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHGF0TI885A
Name 4-(benzenesulfonyl)-6-bromo-3-spiro[3H-1,4-benzoxazine-2,1'-cyclopropane]carboxylic acid methyl ester
Alternate Name(s) 4-besyl-6-bromo-spiro[3H-1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylic acid methyl ester Methyl 4-(benzenesulfonyl)-6-bromo-spiro[3H-1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylate Methyl 6-bromanyl-4-(phenylsulfonyl)spiro[3H-1,4-benzoxazine-2,1'-cyclopropane]-3-carboxylate
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Formula C18H16BrNO5S
InChI InChI=1S/C18H16BrNO5S/c1-24-17(21)16-18(9-10-18)25-15-8-7-12(19)11-14(15)20(16)26(22,23)13-5-3-2-4-6-13/h2-8,11,16H,9-10H2,1H3
InChIKey FIEHJBILQJBEAS-UHFFFAOYSA-N
Molecular Weight 438.292 g/mol
SMILES c1(S(N2C(C3(CC3)Oc3c2cc(cc3)Br)C(=O)OC)(=O)=O)ccccc1
SPLASH splash10-0002-0090000000-4b3e2ef3036abd30ba2c
Source of Spectrum K1-2003-993-24
Wiley ID 1520823