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[3-acetoxy-5-[(Z)-16-(3,5-diacetoxyphenyl)hexadec-8-enyl]phenyl] acetate
SpectraBase Compound ID 7cMXH2XOc6
InChI InChI=1S/C36H48O8/c1-27(37)41-33-21-31(22-34(25-33)42-28(2)38)19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-32-23-35(43-29(3)39)26-36(24-32)44-30(4)40/h5-6,21-26H,7-20H2,1-4H3/b6-5-
InChIKey ZNYYCGPMUNCTAV-WAYWQWQTSA-N
Mol Weight 608.8 g/mol
Molecular Formula C36H48O8
Exact Mass 608.334918 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GixngUaQHVk
Name [3-acetoxy-5-[(Z)-16-(3,5-diacetoxyphenyl)hexadec-8-enyl]phenyl] acetate
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Formula C36H48O8
InChI InChI=1S/C36H48O8/c1-27(37)41-33-21-31(22-34(25-33)42-28(2)38)19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-32-23-35(43-29(3)39)26-36(24-32)44-30(4)40/h5-6,21-26H,7-20H2,1-4H3/b6-5-
InChIKey ZNYYCGPMUNCTAV-WAYWQWQTSA-N
Instrument Name JEOL HX-110
Ionization Type EI
Literature Reference DOI 10.1021/np0201568
Molecular Weight 608.772 g/mol
Reported Formula C36H48O8
SMILES CC(=O)Oc1cc(CCCCCCC\C=C/CCCCCCCc2cc(cc(c2)OC(C)=O)OC(C)=O)cc(c1)OC(C)=O
SPLASH splash10-08fr-9470111000-e52eaebafb11de9be347
Source of Spectrum G4-65-1631-11
Wiley ID 1883460