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(1E)-3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanal oxime

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1E)-3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanal oxime
SpectraBase Compound ID E5xU7bz9Opi
InChI InChI=1S/C10H10N2O2S/c13-10-12(7-3-6-11-14)8-4-1-2-5-9(8)15-10/h1-2,4-6,14H,3,7H2/b11-6+
InChIKey XRLXLFGUXAHBIP-IZZDOVSWSA-N
Mol Weight 222.26 g/mol
Molecular Formula C10H10N2O2S
Exact Mass 222.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2k4txz4x49n
Name 1,3-Benzothiazole-3-propanal, 2,3-dihydro-2-oxo-, oxime
Alternate Name(s) (1E)-3-(2-keto-1,3-benzothiazol-3-yl)propionaldoxime (1E)-3-(2-oxo-1,3-benzothiazol-3-yl)propanal oxime 3-[(3E)-3-hydroxyiminopropyl]-1,3-benzothiazol-2-one
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Formula C10H10N2O2S
InChI InChI=1S/C10H10N2O2S/c13-10-12(7-3-6-11-14)8-4-1-2-5-9(8)15-10/h1-2,4-6,14H,3,7H2/b11-6+
InChIKey XRLXLFGUXAHBIP-IZZDOVSWSA-N
Molecular Weight 222.262 g/mol
SMILES O\N=C\CCN1C(Sc2ccccc12)=O
SPLASH splash10-000i-2920000000-4af805574794de60ff53
Wiley ID 1449946