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Pyrimidine, 5-chloro-2-(2-propynylsulfonyl)-
SpectraBase Compound ID KhADntDxhoS
InChI InChI=1S/C7H5ClN2O2S/c1-2-3-13(11,12)7-9-4-6(8)5-10-7/h1,4-5H,3H2
InChIKey BWUJMEZKIIPFMG-UHFFFAOYSA-N
Mol Weight 216.64 g/mol
Molecular Formula C7H5ClN2O2S
Exact Mass 215.976026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nMvkGoPiqH
Name Pyrimidine, 5-chloro-2-(2-propynylsulfonyl)-
Alternate Name(s) 5-Chloro-2-(2-propynylsulfonyl)pyrimidine 5-Chloro-2-propargylsulfonylpyrimidine 5-Chloro-2-pyrimidinyl 2-propynyl sulfone
CAS Registry Number 86984-26-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5ClN2O2S
InChI InChI=1S/C7H5ClN2O2S/c1-2-3-13(11,12)7-9-4-6(8)5-10-7/h1,4-5H,3H2
InChIKey BWUJMEZKIIPFMG-UHFFFAOYSA-N
Molecular Weight 216.642 g/mol
SMILES c1(S(=O)(=O)CC#C)ncc(cn1)Cl
SPLASH splash10-0j4r-2900000000-d31bcaaa87fc4f536171
Source of Spectrum SB-37-118-0
Wiley ID 1214910