CID 369614

Eriodictyol tetraacetate

Structural Information

Molecular Formula
C23H20O10
SMILES
CC(=O)OC1=C(C=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3OC(=O)C)OC(=O)C)OC(=O)C
InChI
InChI=1S/C23H20O10/c1-11(24)29-16-8-21(32-14(4)27)23-17(28)10-19(33-22(23)9-16)15-5-6-18(30-12(2)25)20(7-15)31-13(3)26/h5-9,19H,10H2,1-4H3
InChIKey
ZDLMCGHYUROZBQ-UHFFFAOYSA-N
Compound name
[2-acetyloxy-4-(5,7-diacetyloxy-4-oxo-2,3-dihydrochromen-2-yl)phenyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

456.10565 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 457.112926 197.5
[M+Na]+ 479.094868 203.5
[M-H]- 455.098374 205.7
[M+NH4]+ 474.139473 205.2
[M+K]+ 495.068808 205.6
[M+H-H2O]+ 439.102910 188.6
[M+HCOO]- 501.103851 213.3
[M+CH3COO]- 515.119501 234.5
[M+Na-2H]- 477.080316 195.8
[M]+ 456.10510142 206.7
[M]- 456.10619858 206.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe