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(Z)-2-Amino-2-trichloromethyl-4-(1,3-benzodioxol-5-ylmethylene)-1,3-oxathiolan-5-one
SpectraBase Compound ID J6z0dA4BCt0
InChI InChI=1S/C12H8Cl3NO4S/c13-11(14,15)12(16)20-10(17)9(21-12)4-6-1-2-7-8(3-6)19-5-18-7/h1-4H,5,16H2/b9-4-
InChIKey FXVHTWIOLKNFPZ-WTKPLQERSA-N
Mol Weight 368.62 g/mol
Molecular Formula C12H8Cl3NO4S
Exact Mass 366.923962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HM4dg3vZKY
Name (Z)-2-Amino-2-trichloromethyl-4-(1,3-benzodioxol-5-ylmethylene)-1,3-oxathiolan-5-one
Appearance Pale yellow crystals
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Formula C12H8Cl3NO4S
InChI InChI=1S/C12H8Cl3NO4S/c13-11(14,15)12(16)20-10(17)9(21-12)4-6-1-2-7-8(3-6)19-5-18-7/h1-4H,5,16H2/b9-4-
InChIKey FXVHTWIOLKNFPZ-WTKPLQERSA-N
Instrument Name Shimadzu GCMS-GB 1000 PX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0012.a20
Molecular Weight 368.618 g/mol
SMILES NC1(C(Cl)(Cl)Cl)OC(=O)\C(=C\c2cc3c(cc2)OCO3)S1
SPLASH splash10-004i-0900000000-9d52ad5326d137f569d3
Source of Spectrum ARK-2011-261-4b
Wiley ID 1864324