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3'-Chloro-3,4-dihydro-4-methyl-3-oxo-4'-vinyl-1,4-benzothiazine-2-spiro-1'-cyclopentane-3'-carbaldehyde isomer
SpectraBase Compound ID vwT2ufq9nA
InChI InChI=1S/C16H17NO2S/c1-3-11-8-16(9-12(11)10-18)15(19)17(2)13-6-4-5-7-14(13)20-16/h3-7,10-12H,1,8-9H2,2H3
InChIKey NOLAZWAFZGQOFJ-UHFFFAOYSA-N
Mol Weight 287.38 g/mol
Molecular Formula C16H17NO2S
Exact Mass 287.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnFLHu5rTUR
Name 3'-Chloro-3,4-dihydro-4-methyl-3-oxo-4'-vinyl-1,4-benzothiazine-2-spiro-1'-cyclopentane-3'-carbaldehyde isomer
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO2S
InChI InChI=1S/C16H17NO2S/c1-3-11-8-16(9-12(11)10-18)15(19)17(2)13-6-4-5-7-14(13)20-16/h3-7,10-12H,1,8-9H2,2H3
InChIKey NOLAZWAFZGQOFJ-UHFFFAOYSA-N
Molecular Weight 287.377 g/mol
SMILES C12(C(N(C)c3c(S2)cccc3)=O)CC(C=C)C(C1)C=O
SPLASH splash10-0006-0950000000-7cf54168590657478fa9
Source of Spectrum E2-46-916-5
Synonyms 2'-ethenyl-4-methyl-3-oxo-1'-spiro[1,4-benzothiazine-2,4'-cyclopentane]carboxaldehyde 2'-ethenyl-4-methyl-3-oxospiro[1,4-benzothiazine-2,4'-cyclopentane]-1'-carbaldehyde 4-methyl-3-oxo-2'-vinyl-spiro[1,4-benzothiazine-2,4'-cyclopentane]-1'-carbaldehyde 2'-ethenyl-4-methyl-3-oxidanylidene-spiro[1,4-benzothiazine-2,4'-cyclopentane]-1'-carbaldehyde
Wiley ID 1554491