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Ethyl 5-(1,3-dithian-2-yl)-5-hydroxy-2-methyl-1-cyclohexene-1-carboxylate
SpectraBase Compound ID 6MvIl0UnRyf
InChI InChI=1S/C14H22O3S2/c1-3-17-12(15)11-9-14(16,6-5-10(11)2)13-18-7-4-8-19-13/h13,16H,3-9H2,1-2H3
InChIKey XYNIRJSWXIJGIO-UHFFFAOYSA-N
Mol Weight 302.45 g/mol
Molecular Formula C14H22O3S2
Exact Mass 302.101037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 221ofhkOWW6
Name Ethyl 5-(1,3-dithian-2-yl)-5-hydroxy-2-methyl-1-cyclohexene-1-carboxylate
Alternate Name(s) 2-(3-Carbethoxy-1-hydroxy-4-methylcyclohex-3-enyl)-1,3-dithiane 5-(1,3-dithian-2-yl)-5-hydroxy-2-methyl-1-cyclohexenecarboxylic acid ethyl ester Ethyl 5-(1,3-dithian-2-yl)-5-hydroxy-2-methylcyclohexene-1-carboxylate Ethyl 5-(1,3-dithian-2-yl)-5-hydroxy-2-methyl-cyclohexene-1-carboxylate Ethyl 5-(1,3-dithian-2-yl)-2-methyl-5-oxidanyl-cyclohexene-1-carboxylate
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Formula C14H22O3S2
InChI InChI=1S/C14H22O3S2/c1-3-17-12(15)11-9-14(16,6-5-10(11)2)13-18-7-4-8-19-13/h13,16H,3-9H2,1-2H3
InChIKey XYNIRJSWXIJGIO-UHFFFAOYSA-N
Molecular Weight 302.447 g/mol
SMILES OC1(CC(C(=O)OCC)=C(CC1)C)C1SCCCS1
SPLASH splash10-00dr-5900000000-b069f1455b6333475e0c
Source of Spectrum NP-10-1939-0
Wiley ID 1108717