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15,17-Diacetoxy-(ent)-Isocopal-12-en-16-al
SpectraBase Compound ID IyWBOx2SaEz
InChI InChI=1S/C24H36O5/c1-16(26)28-14-19-18(13-25)7-8-21-23(5)11-6-10-22(3,4)20(23)9-12-24(19,21)15-29-17(2)27/h7,13,19-21H,6,8-12,14-15H2,1-5H3/t19?,20?,21?,23-,24?/m0/s1
InChIKey KJVZXZTVUIIMDW-HZHDVADBSA-N
Mol Weight 404.5 g/mol
Molecular Formula C24H36O5
Exact Mass 404.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMWEKjuFGWH
Name 15,17-Diacetoxy-(ent)-Isocopal-12-en-16-al
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O5
InChI InChI=1S/C24H36O5/c1-16(26)28-14-19-18(13-25)7-8-21-23(5)11-6-10-22(3,4)20(23)9-12-24(19,21)15-29-17(2)27/h7,13,19-21H,6,8-12,14-15H2,1-5H3/t19?,20?,21?,23-,24?/m0/s1
InChIKey KJVZXZTVUIIMDW-HZHDVADBSA-N
Molecular Weight 404.547 g/mol
SMILES C12(C([C@]3(CCCC(C3CC2)(C)C)C)CC=C(C1COC(=O)C)C=O)COC(=O)C
SPLASH splash10-0kmo-6897000000-49b4fabe5185cd2c2889
Source of Spectrum X2-57-730-15
Wiley ID 1605436