For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Chloro-5-butoxy-4-thiocyanatofuran-2(5H)-one
SpectraBase Compound ID 3ntCnavyNDF
InChI InChI=1S/C9H10ClNO3S/c1-2-3-4-13-9-7(15-5-11)6(10)8(12)14-9/h9H,2-4H2,1H3
InChIKey MMCSNCBWQSSDRL-UHFFFAOYSA-N
Mol Weight 247.7 g/mol
Molecular Formula C9H10ClNO3S
Exact Mass 247.006992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HtzdhHKLlmv
Name 3-Chloro-5-butoxy-4-thiocyanatofuran-2(5H)-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10ClNO3S
InChI InChI=1S/C9H10ClNO3S/c1-2-3-4-13-9-7(15-5-11)6(10)8(12)14-9/h9H,2-4H2,1H3
InChIKey MMCSNCBWQSSDRL-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP5000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900749
Molecular Weight 247.696 g/mol
Quality 881
SMILES C1(OC(C(=C1Cl)SC#N)OCCCC)=O
SPLASH splash10-00dj-4900000000-9d3cfcc00f6a0bf65a4d
Source of Spectrum K1-2019-SM34-4d (DOI: 10.1002/ejoc.201900749)
Wiley ID 1891950