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Dimethyl 5-butyl-6-(hex-1-ynyl)deca-2,5,8-trienedioate
SpectraBase Compound ID DFzWmjj944J
InChI InChI=1S/C22H32O4/c1-5-7-9-10-14-20(16-12-18-22(24)26-4)19(13-8-6-2)15-11-17-21(23)25-3/h11-12,17-18H,5-9,13,15-16H2,1-4H3/b17-11+,18-12+,20-19+
InChIKey RBILXYUCSUVJBL-DDMOJJROSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6ejuOKcB3a
Name Dimethyl 5-butyl-6-(hex-1-ynyl)deca-2,5,8-trienedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-5-7-9-10-14-20(16-12-18-22(24)26-4)19(13-8-6-2)15-11-17-21(23)25-3/h11-12,17-18H,5-9,13,15-16H2,1-4H3/b17-11+,18-12+,20-19+
InChIKey RBILXYUCSUVJBL-DDMOJJROSA-N
Literature Reference DOI 10.1002/adsc.201000430
Molecular Weight 360.494 g/mol
SMILES C(\C(C#CCCCC)=C/(CCCC)C\C=C\C(OC)=O)\C=C\C(OC)=O
SPLASH splash10-03di-0009000000-7456425c218389f15609
Source of Spectrum ASC-352-2887/SM14-10a
Synonyms (2E,5Z,8E)-dimethyl 5-butyl-6-(hex-1-yn-1-yl)deca-2,5,8-trienedioate (2E,5Z,8E)-5-butyl-6-hex-1-ynyldeca-2,5,8-trienedioic acid dimethyl ester Dimethyl (2E,5Z,8E)-5-butyl-6-hex-1-ynyldeca-2,5,8-trienedioate Dimethyl (2E,5Z,8E)-5-butyl-6-hex-1-ynyl-deca-2,5,8-trienedioate
Wiley ID 1764081