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5-(ethylthio)-3-(1'hydroxycyclohexyl)furan-2(5H)-one
SpectraBase Compound ID 85ibMv5xByT
InChI InChI=1S/C12H18O3S/c1-2-16-10-8-9(11(13)15-10)12(14)6-4-3-5-7-12/h8,10,14H,2-7H2,1H3
InChIKey XXUWDPALPQRJLZ-UHFFFAOYSA-N
Mol Weight 242.33 g/mol
Molecular Formula C12H18O3S
Exact Mass 242.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EuvJSICuCPl
Name 5-(ethylthio)-3-(1'hydroxycyclohexyl)furan-2(5H)-one
CAS Registry Number 114583-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3S
InChI InChI=1S/C12H18O3S/c1-2-16-10-8-9(11(13)15-10)12(14)6-4-3-5-7-12/h8,10,14H,2-7H2,1H3
InChIKey XXUWDPALPQRJLZ-UHFFFAOYSA-N
Molecular Weight 242.333 g/mol
SMILES OC1(C=2C(OC(C2)SCC)=O)CCCCC1
SPLASH splash10-022i-0960000000-f27dfc1937602629fb8f
Source of Spectrum J-53-3333-11
Synonyms 5-(ethylsulfanyl)-3-(1-hydroxycyclohexyl)-2(5H)-furanone
Wiley ID 1244807