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endo-Z,Z'-(3.8',8.3')diligustilide
SpectraBase Compound ID EU1Dh6JjKwD
InChI InChI=1S/C24H28O4/c1-3-9-19-23(17-13-7-5-11-15(17)21(25)27-23)20(10-4-2)24(19)18-14-8-6-12-16(18)22(26)28-24/h5-6,11-12,19-20H,3-4,7-10,13-14H2,1-2H3/t19-,20+,23+,24-
InChIKey NBGKKTXKGJBVAL-XZOTUCIWSA-N
Mol Weight 380.48 g/mol
Molecular Formula C24H28O4
Exact Mass 380.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9BQ4mwrv1Io
Name endo-Z,Z'-(3.8',8.3')diligustilide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O4
InChI InChI=1S/C24H28O4/c1-3-9-19-23(17-13-7-5-11-15(17)21(25)27-23)20(10-4-2)24(19)18-14-8-6-12-16(18)22(26)28-24/h5-6,11-12,19-20H,3-4,7-10,13-14H2,1-2H3/t19-,20+,23+,24-
InChIKey NBGKKTXKGJBVAL-XZOTUCIWSA-N
Molecular Weight 380.484 g/mol
SMILES [C@]12(C3=C(C=CCC3)C(O1)=O)[C@](CCC)([C@]1([C@@]2(CCC)[H])C2=C(C=CCC2)C(O1)=O)[H]
SPLASH splash10-000g-0900000000-7f27c89dadc2ea3fef05
Source of Spectrum Y1-46-3006-7
Wiley ID 1622431