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2-Allyl-5-[(E)-1-hydroxydec-4-enyl]thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID KS3Qt3a99yM
InChI InChI=1S/C20H30O3S/c1-4-7-8-9-10-11-12-14-17(21)19-15-16(20(22)23-6-3)18(24-19)13-5-2/h5,10-11,15,17,21H,2,4,6-9,12-14H2,1,3H3/b11-10+
InChIKey VADPZCINBFDGMY-ZHACJKMWSA-N
Mol Weight 350.52 g/mol
Molecular Formula C20H30O3S
Exact Mass 350.191566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9oaSN1FfYpd
Name 2-Allyl-5-[(E)-1-hydroxydec-4-enyl]thiophene-3-carboxylic acid ethyl ester
Alternate Name(s) 5-[(E)-1-hydroxydec-4-enyl]-2-prop-2-enyl-3-thiophenecarboxylic acid ethyl ester Ethyl 2-allyl-5-[(E)-1-hydroxydec-4-enyl]thiophene-3-carboxylate Ethyl 5-[(E)-1-hydroxydec-4-enyl]-2-prop-2-enylthiophene-3-carboxylate Ethyl 5-[(E)-1-oxidanyldec-4-enyl]-2-prop-2-enyl-thiophene-3-carboxylate
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Formula C20H30O3S
InChI InChI=1S/C20H30O3S/c1-4-7-8-9-10-11-12-14-17(21)19-15-16(20(22)23-6-3)18(24-19)13-5-2/h5,10-11,15,17,21H,2,4,6-9,12-14H2,1,3H3/b11-10+
InChIKey VADPZCINBFDGMY-ZHACJKMWSA-N
Molecular Weight 350.517 g/mol
SMILES OC(c1cc(c(s1)CC=C)C(=O)OCC)CC\C=C\CCCCC
SPLASH splash10-004r-0091000000-cc707eccfc18c51bf77e
Source of Spectrum J-65-4632-25
Wiley ID 1532878