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Albaspidin A-A
SpectraBase Compound ID ZdkY0lgylV
InChI InChI=1S/C23H28O8/c1-7-12(24)14-16(26)10(18(28)22(3,4)20(14)30)9-11-17(27)15(13(25)8-2)21(31)23(5,6)19(11)29/h28-31H,7-9H2,1-6H3
InChIKey AVXBWZLPMWIFHX-UHFFFAOYSA-N
Mol Weight 432.47 g/mol
Molecular Formula C23H28O8
Exact Mass 432.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Dqwj0MnKXB
Name Albaspidin A-A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O8
InChI InChI=1S/C23H28O8/c1-7-12(24)14-16(26)10(18(28)22(3,4)20(14)30)9-11-17(27)15(13(25)8-2)21(31)23(5,6)19(11)29/h28-31H,7-9H2,1-6H3
InChIKey AVXBWZLPMWIFHX-UHFFFAOYSA-N
Molecular Weight 432.469 g/mol
SMILES OC=1C(C(=C(C(C1CC1=C(C(C(=C(C1=O)C(=O)CC)O)(C)C)O)=O)C(=O)CC)O)(C)C
SPLASH splash10-01x0-0970600000-918474e8ecaf345edb3b
Source of Spectrum X2-52-330-5
Synonyms 2,2'-bis[4,4-Dimethyl-5-hydroxy-6-propanoyl-1-oxo-1,4-dihydrocyclohexan-2-yl)-methylene
Wiley ID 1603100