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3-[2'-(Methylsulfonyl)-5'-methyl-3'-thienyl]-5-chloromethyl-1,2,4-thiadiazole
SpectraBase Compound ID 7RsW20WSFxI
InChI InChI=1S/C9H9ClN2O2S3/c1-5-3-6(9(15-5)17(2,13)14)8-11-7(4-10)16-12-8/h3H,4H2,1-2H3
InChIKey DJONVUXJFURINV-UHFFFAOYSA-N
Mol Weight 308.82 g/mol
Molecular Formula C9H9ClN2O2S3
Exact Mass 307.951469 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgYP68WD2xt
Name 3-[2'-(Methylsulfonyl)-5'-methyl-3'-thienyl]-5-chloromethyl-1,2,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClN2O2S3
InChI InChI=1S/C9H9ClN2O2S3/c1-5-3-6(9(15-5)17(2,13)14)8-11-7(4-10)16-12-8/h3H,4H2,1-2H3
InChIKey DJONVUXJFURINV-UHFFFAOYSA-N
Molecular Weight 308.816 g/mol
SMILES c1(c(S(=O)(=O)C)sc(c1)C)-c1nc(CCl)sn1
SPLASH splash10-0a4i-0029000000-0c05f366f8edef9d1784
Source of Spectrum F9-1992-1896-8
Synonyms 3-[5-(chloromethyl)-1,2,4-thiadiazol-3-yl]-5-methyl-2-thienyl methyl sulfone 5-(chloromethyl)-3-[5-methyl-2-(methylsulfonyl)-3-thienyl]-1,2,4-thiadiazole
Wiley ID 1566618