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Cornexisin bis methyl ester (dimethyl 4-ethenyl-5,8-dihydroxy-7-oxo-9-propylcyclononen-1,2-dicarboxylate)
SpectraBase Compound ID 2g4GgFSU2BH
InChI InChI=1S/C18H26O7/c1-5-7-11-15(18(23)25-4)12(17(22)24-3)8-10(6-2)13(19)9-14(20)16(11)21/h6,11,13,16,19,21H,5,7-9H2,1-4H3/b10-6-,15-12-/t11-,13-,16-/m0/s1
InChIKey NERQXCTYSCJGGX-FYTUEIKESA-N
Mol Weight 354.4 g/mol
Molecular Formula C18H26O7
Exact Mass 354.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVXrglVZi8f
Name Cornexisin bis methyl ester (dimethyl 4-ethenyl-5,8-dihydroxy-7-oxo-9-propylcyclononen-1,2-dicarboxylate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O7
InChI InChI=1S/C18H26O7/c1-5-7-11-15(18(23)25-4)12(17(22)24-3)8-10(6-2)13(19)9-14(20)16(11)21/h6,11,13,16,19,21H,5,7-9H2,1-4H3/b10-6-,15-12-/t11-,13-,16-/m0/s1
InChIKey NERQXCTYSCJGGX-FYTUEIKESA-N
Molecular Weight 354.399 g/mol
SMILES O[C@]1(CC([C@]([C@](\C(=C/(C\C1=C/C)C(=O)OC)C(=O)OC)(CCC)[H])(O)[H])=O)[H]
SPLASH splash10-0a4m-9030000000-f00eac9217113f375bba
Source of Spectrum AT-37-1970-2
Wiley ID 853521