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erythro-.alpha.-1,2-dimethyl-2-methoxycarbonylaminoethyl-2'-chloroethylsulfoxide
SpectraBase Compound ID GyLHbNF205Q
InChI InChI=1S/C8H16ClNO3S/c1-6(10-8(11)13-3)7(2)14(12)5-4-9/h6-7H,4-5H2,1-3H3,(H,10,11)
InChIKey AKXSXYZABZFPMV-UHFFFAOYSA-N
Mol Weight 241.73 g/mol
Molecular Formula C8H16ClNO3S
Exact Mass 241.053942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSOsgbTjuuB
Name erythro-.alpha.-1,2-dimethyl-2-methoxycarbonylaminoethyl-2'-chloroethylsulfoxide
Alternate Name(s) Methyl 2-[(2-chloroethyl)sulfinyl]-1-methylpropylcarbamate
CAS Registry Number 116471-11-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16ClNO3S
InChI InChI=1S/C8H16ClNO3S/c1-6(10-8(11)13-3)7(2)14(12)5-4-9/h6-7H,4-5H2,1-3H3,(H,10,11)
InChIKey AKXSXYZABZFPMV-UHFFFAOYSA-N
Molecular Weight 241.733 g/mol
SMILES N(C(=O)OC)C(C(S(=O)CCCl)C)C
SPLASH splash10-001i-7900000000-2556009c18d458fcf99e
Source of Spectrum F-44-1428-3
Wiley ID 1243771