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3-Chloro-5-(2-chloroethoxy)-4-thiocyanatofuran-2(5H)-one
SpectraBase Compound ID 93ftgqBj3XN
InChI InChI=1S/C7H5Cl2NO3S/c8-1-2-12-7-5(14-3-10)4(9)6(11)13-7/h7H,1-2H2
InChIKey FGMMUJFKZNUYCU-UHFFFAOYSA-N
Mol Weight 254.09 g/mol
Molecular Formula C7H5Cl2NO3S
Exact Mass 252.93672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSu5CDNjHqy
Name 3-Chloro-5-(2-chloroethoxy)-4-thiocyanatofuran-2(5H)-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5Cl2NO3S
InChI InChI=1S/C7H5Cl2NO3S/c8-1-2-12-7-5(14-3-10)4(9)6(11)13-7/h7H,1-2H2
InChIKey FGMMUJFKZNUYCU-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP5000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900749
Molecular Weight 254.087 g/mol
Quality 492
SMILES C1(OC(C(=C1Cl)SC#N)OCCCl)=O
SPLASH splash10-02mj-3900000000-1c7565ebed778e737452
Source of Spectrum K1-2019-SM40-4h (DOI: 10.1002/ejoc.201900749)
Wiley ID 1891952