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Benzyl 1'-(3''-methoxy-3''-oxopropionyloxy)-4'-methylnon-3'-ene-5' -yl Carbonate
SpectraBase Compound ID Ca2HfiE2Pis
InChI InChI=1S/C22H30O7/c1-4-5-13-19(29-22(25)28-16-18-11-7-6-8-12-18)17(2)10-9-14-27-21(24)15-20(23)26-3/h6-8,10-12,19H,4-5,9,13-16H2,1-3H3/b17-10+
InChIKey WTDVMMPIUGPTHT-LICLKQGHSA-N
Mol Weight 406.48 g/mol
Molecular Formula C22H30O7
Exact Mass 406.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NPk9HOmHu3
Name Benzyl 1'-(3''-methoxy-3''-oxopropionyloxy)-4'-methylnon-3'-ene-5' -yl Carbonate
Alternate Name(s) Propanedioic acid O1-methyl ester O3-[(E)-4-methyl-5-phenylmethoxycarbonyloxynon-3-enyl] ester 1-O-methyl 3-O-[(E)-4-methyl-5-phenylmethoxycarbonyloxynon-3-enyl] propanedioate O3-[(E)-5-benzyloxycarbonyloxy-4-methyl-non-3-enyl] O1-methyl propanedioate O1-methyl O3-[(E)-4-methyl-5-phenylmethoxycarbonyloxy-non-3-enyl] propanedioate
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Formula C22H30O7
InChI InChI=1S/C22H30O7/c1-4-5-13-19(29-22(25)28-16-18-11-7-6-8-12-18)17(2)10-9-14-27-21(24)15-20(23)26-3/h6-8,10-12,19H,4-5,9,13-16H2,1-3H3/b17-10+
InChIKey WTDVMMPIUGPTHT-LICLKQGHSA-N
Molecular Weight 406.475 g/mol
SMILES C(OC(\C(=C\CCOC(CC(=O)OC)=O)C)CCCC)(=O)OCc1ccccc1
SPLASH splash10-0006-9100000000-4bf7ee9fe30caec295fa
Source of Spectrum U1-2011-6523-8d
Wiley ID 1703040