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2-[5-(Chloromethyl)-1,3-oxathiolan-2-ylidene]propanedinitrile
SpectraBase Compound ID DExwsIgyVn7
InChI InChI=1S/C7H5ClN2OS/c8-1-6-4-12-7(11-6)5(2-9)3-10/h6H,1,4H2
InChIKey HKKOYARDEVZRQQ-UHFFFAOYSA-N
Mol Weight 200.64 g/mol
Molecular Formula C7H5ClN2OS
Exact Mass 199.981112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WxVrEgkWrY
Name 2-[5-(Chloromethyl)-1,3-oxathiolan-2-ylidene]propanedinitrile
Alternate Name(s) 2-(5-(chloromethyl)-1,3-oxathiolan-2-ylidene)malononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5ClN2OS
InChI InChI=1S/C7H5ClN2OS/c8-1-6-4-12-7(11-6)5(2-9)3-10/h6H,1,4H2
InChIKey HKKOYARDEVZRQQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000231
Molecular Weight 200.643 g/mol
SMILES C(C(C#N)=C1OC(CS1)CCl)#N
SPLASH splash10-0uk9-3900000000-a54a625cb06556148b7f
Source of Spectrum H-94-641-2b
Wiley ID 1785972