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3-Chloro-5-ethoxy-4-thiocyanatofuran-2(5H)-one
SpectraBase Compound ID EVIfUyT8Dar
InChI InChI=1S/C7H6ClNO3S/c1-2-11-7-5(13-3-9)4(8)6(10)12-7/h7H,2H2,1H3
InChIKey LZGFGIACRPFTID-UHFFFAOYSA-N
Mol Weight 219.64 g/mol
Molecular Formula C7H6ClNO3S
Exact Mass 218.975692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2nl3LZTkci
Name 3-Chloro-5-ethoxy-4-thiocyanatofuran-2(5H)-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.975691928 u
Formula C7H6ClNO3S
InChI InChI=1S/C7H6ClNO3S/c1-2-11-7-5(13-3-9)4(8)6(10)12-7/h7H,2H2,1H3
InChIKey LZGFGIACRPFTID-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP5000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900749
Molecular Weight 219.642 g/mol
Quality 901
SMILES C1(OC(C(=C1Cl)SC#N)OCC)=O
SPLASH splash10-01bi-4900000000-5496a5f0d3d4ca39845a
Source of Spectrum K1-2019-SM31-4b (DOI: 10.1002/ejoc.201900749)
Wiley ID 1891949