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Isoannonacin-10-one

View entire compound with spectra: 1 MS (GC)

Isoannonacin-10-one
SpectraBase Compound ID 42pMWCjroPJ
InChI InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(37)18-13-12-14-20-30-26-28(25-27(2)36)35(40)41-30/h28,30-34,38-39H,3-26H2,1-2H3
InChIKey LAURKABBYLWMNU-UHFFFAOYSA-N
Mol Weight 594.9 g/mol
Molecular Formula C35H62O7
Exact Mass 594.449554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrsyxYs8yUC
Name Isoannonacin-10-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H62O7
InChI InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(37)18-13-12-14-20-30-26-28(25-27(2)36)35(40)41-30/h28,30-34,38-39H,3-26H2,1-2H3
InChIKey LAURKABBYLWMNU-UHFFFAOYSA-N
Molecular Weight 594.874 g/mol
SMILES OC(C1OC(C(CCCCC(=O)CCCCCC2OC(C(CC(=O)C)C2)=O)O)CC1)CCCCCCCCCCCC
SPLASH splash10-05br-0198000000-a5b297341d94d72e9508
Source of Spectrum X2-53-254-27
Wiley ID 1603437