CID 146597

116385-33-2

Structural Information

Molecular Formula
C21H24O6
SMILES
CC1C(C2=CC3=C(C=C2OC1(C)OC)OCO3)C4=C(C=C(C=C4)OC)OC
InChI
InChI=1S/C21H24O6/c1-12-20(14-7-6-13(22-3)8-16(14)23-4)15-9-18-19(26-11-25-18)10-17(15)27-21(12,2)24-5/h6-10,12,20H,11H2,1-5H3
InChIKey
OJLSPKZVMHLCBB-UHFFFAOYSA-N
Compound name
8-(2,4-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

372.1573 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.16458 186.6
[M+Na]+ 395.14652 196.0
[M-H]- 371.15002 197.6
[M+NH4]+ 390.19112 201.2
[M+K]+ 411.12046 197.0
[M+H-H2O]+ 355.15456 179.8
[M+HCOO]- 417.15550 202.6
[M+CH3COO]- 431.17115 219.5
[M+Na-2H]- 393.13197 190.6
[M]+ 372.15675 195.3
[M]- 372.15785 195.3
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