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(+)-1-(Benzothiazol-2-ylsulfanyl)-3-chloro-2-acetoxypropane
SpectraBase Compound ID FDvI2xK9s2k
InChI InChI=1S/C12H12ClNO2S2/c1-8(15)16-9(6-13)7-17-12-14-10-4-2-3-5-11(10)18-12/h2-5,9H,6-7H2,1H3/t9-/m1/s1
InChIKey FSBWSOGUYBETPL-SECBINFHSA-N
Mol Weight 301.81 g/mol
Molecular Formula C12H12ClNO2S2
Exact Mass 300.999799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UFEnddyb2
Name (+)-1-(Benzothiazol-2-ylsulfanyl)-3-chloro-2-acetoxypropane
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Formula C12H12ClNO2S2
InChI InChI=1S/C12H12ClNO2S2/c1-8(15)16-9(6-13)7-17-12-14-10-4-2-3-5-11(10)18-12/h2-5,9H,6-7H2,1H3/t9-/m1/s1
InChIKey FSBWSOGUYBETPL-SECBINFHSA-N
Molecular Weight 301.806 g/mol
SMILES c1(nc2ccccc2s1)SC[C@](OC(=O)C)(CCl)[H]
SPLASH splash10-0006-4901000000-8b635118b621e70c8371
Source of Spectrum QC-11-1580-3
Synonyms (S)-(+)-1-(Benzothiazol-2-ylsulfanyl)-3-chloro-2-acetoxypropane 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(chloromethyl)ethyl acetate Acetic acid[1-(1,3-benzothiazol-2-ylthio)-3-chloropropan-2-yl]ester Acetic acid[1-[(1,3-benzothiazol-2-ylthio)methyl]-2-chloro-ethyl]ester [1-(1,3-benzothiazol-2-ylsulfanyl)-3-chloranyl-propan-2-yl]ethanoate [1-(1,3-benzothiazol-2-ylsulfanyl)-3-chloropropan-2-yl]acetate [1-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-chloro-ethyl]acetate
Wiley ID 859768