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Gravicycle
SpectraBase Compound ID LdDxNd51CXu
InChI InChI=1S/C26H36O5/c27-21-15-14-19-12-10-8-6-4-2-1-3-5-7-9-11-13-22(28)20-16-23(29)26(24(30)17-20)31-25(19)18-21/h14-18,22,27-30H,1-13H2
InChIKey ATFUSLMQYYSJKN-UHFFFAOYSA-N
Mol Weight 428.6 g/mol
Molecular Formula C26H36O5
Exact Mass 428.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7WDtNfQhfJ
Name Gravicycle
Alternate Name(s) {R}-1""-Hydroxyrobustol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O5
InChI InChI=1S/C26H36O5/c27-21-15-14-19-12-10-8-6-4-2-1-3-5-7-9-11-13-22(28)20-16-23(29)26(24(30)17-20)31-25(19)18-21/h14-18,22,27-30H,1-13H2
InChIKey ATFUSLMQYYSJKN-UHFFFAOYSA-N
Molecular Weight 428.569 g/mol
SMILES OC1CCCCCCCCCCCCCc2ccc(cc2Oc2c(cc1cc2O)O)O
SPLASH splash10-004i-0120900000-42cce7ba5b9abcfb8550
Source of Spectrum G4-70-321-1
Wiley ID 1694685