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2-Allyl-5-(1-hydroxybut-2-enyl)thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID 8TbHtgeeb4Q
InChI InChI=1S/C14H18O3S/c1-4-7-11(15)13-9-10(14(16)17-6-3)12(18-13)8-5-2/h4-5,7,9,11,15H,2,6,8H2,1,3H3/b7-4+
InChIKey YUEFONKLHQQKRJ-QPJJXVBHSA-N
Mol Weight 266.35 g/mol
Molecular Formula C14H18O3S
Exact Mass 266.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkMQbe5oQDK
Name 2-Allyl-5-(1-hydroxybut-2-enyl)thiophene-3-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 2-allyl-5-[(2E)-1-hydroxy-2-butenyl]-3-thiophenecarboxylate 5-[(E)-1-hydroxybut-2-enyl]-2-prop-2-enyl-3-thiophenecarboxylic acid ethyl ester Ethyl 5-[(E)-1-hydroxybut-2-enyl]-2-prop-2-enylthiophene-3-carboxylate Ethyl 2-allyl-5-[(E)-1-hydroxybut-2-enyl]thiophene-3-carboxylate Ethyl 5-[(E)-1-oxidanylbut-2-enyl]-2-prop-2-enyl-thiophene-3-carboxylate
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Formula C14H18O3S
InChI InChI=1S/C14H18O3S/c1-4-7-11(15)13-9-10(14(16)17-6-3)12(18-13)8-5-2/h4-5,7,9,11,15H,2,6,8H2,1,3H3/b7-4+
InChIKey YUEFONKLHQQKRJ-QPJJXVBHSA-N
Molecular Weight 266.355 g/mol
SMILES OC(c1cc(c(s1)CC=C)C(=O)OCC)\C=C\C
SPLASH splash10-014j-0390000000-52ad941de636ed768c40
Source of Spectrum J-65-4632-25
Wiley ID 1532879