CID 11795135

Dulxanthone e

Structural Information

Molecular Formula
C22H22O7
SMILES
CC1(C=CC2=C(O1)C(=C3C(=C2OC)C(=O)C4=C(O3)C(=C(C=C4)OC)OC)OC)C
InChI
InChI=1S/C22H22O7/c1-22(2)10-9-12-16(25-4)14-15(23)11-7-8-13(24-3)19(26-5)17(11)28-20(14)21(27-6)18(12)29-22/h7-10H,1-6H3
InChIKey
DLIXREHRECIYQJ-UHFFFAOYSA-N
Compound name
5,9,10,12-tetramethoxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

398.13657 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.14385 191.7
[M+Na]+ 421.12579 204.8
[M-H]- 397.12929 201.0
[M+NH4]+ 416.17039 206.1
[M+K]+ 437.09973 205.1
[M+H-H2O]+ 381.13383 182.4
[M+HCOO]- 443.13477 209.8
[M+CH3COO]- 457.15042 227.6
[M+Na-2H]- 419.11124 199.2
[M]+ 398.13602 206.0
[M]- 398.13712 206.0
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

No patent data available for this compound.