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(1S,2S)-2,3-Dihydro-2-methyl-1,5-benzothiazepin-4(5H)-one 1-oxide
SpectraBase Compound ID ELVR1CK4t0f
InChI InChI=1S/C10H11NO2S/c1-7-6-10(12)11-8-4-2-3-5-9(8)14(7)13/h2-5,7H,6H2,1H3,(H,11,12)/t7-,14?/m0/s1
InChIKey YOLWJCKHBIYKBT-CVSPRKDYSA-N
Mol Weight 209.26 g/mol
Molecular Formula C10H11NO2S
Exact Mass 209.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 890w1ZpdGKF
Name (1S,2S)-2,3-Dihydro-2-methyl-1,5-benzothiazepin-4(5H)-one 1-oxide
Alternate Name(s) (1S,2S)-1-keto-2-methyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one (1S,2S)-2-methyl-1-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-4-one (1S,2S)-2-methyl-1-oxo-3,5-dihydro-2H-1,5-benzothiazepin-4-one (2S)-2-methyl-2,3-dihydro-1,5-benzothiazepin-4(5H)-one 1-oxide cis-2,3-Dihydro-2-methyl-1,5-benzothiazepin-4(5H)-one 1-oxide
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Formula C10H11NO2S
InChI InChI=1S/C10H11NO2S/c1-7-6-10(12)11-8-4-2-3-5-9(8)14(7)13/h2-5,7H,6H2,1H3,(H,11,12)/t7-,14?/m0/s1
InChIKey YOLWJCKHBIYKBT-CVSPRKDYSA-N
Molecular Weight 209.263 g/mol
SMILES N1C(C[C@@]([S@@](c2c1cccc2)=O)(C)[H])=O
SPLASH splash10-014i-9400000000-c8b08012f5a935c82fc6
Source of Spectrum H1-51-90-2
Wiley ID 817049