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Dimethyl 3-(methyl)-2-(4-bromophenyl)imino-1,3-thiazolane-4,5-dicarboxylate
SpectraBase Compound ID 5gAhFdPU4gB
InChI InChI=1S/C14H15BrN2O4S/c1-17-10(12(18)20-2)11(13(19)21-3)22-14(17)16-9-6-4-8(15)5-7-9/h4-7,10-11H,1-3H3
InChIKey RBBCZNFUEDKFSP-UHFFFAOYSA-N
Mol Weight 387.25 g/mol
Molecular Formula C14H15BrN2O4S
Exact Mass 385.993591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgS2rF8i6Lp
Name Dimethyl 3-(methyl)-2-(4-bromophenyl)imino-1,3-thiazolane-4,5-dicarboxylate
Appearance Yellow crystals
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Formula C14H15BrN2O4S
InChI InChI=1S/C14H15BrN2O4S/c1-17-10(12(18)20-2)11(13(19)21-3)22-14(17)16-9-6-4-8(15)5-7-9/h4-7,10-11H,1-3H3
InChIKey RBBCZNFUEDKFSP-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2789
Molecular Weight 387.248 g/mol
SMILES COC(=O)C1N(C(SC1C(=O)OC)=Nc1ccc(cc1)Br)C
SPLASH splash10-0a59-9508000000-66b381c527c26625f6a1
Source of Spectrum Y-54-1940-4e
Wiley ID 1878357