CID 244553

Dibenzo[d,f][1,2]dioxocin, 5,8-dihydro-5,8-dimethoxy-

Structural Information

Molecular Formula
C16H16O4
SMILES
COC1C2=CC=CC=C2C3=CC=CC=C3C(OO1)OC
InChI
InChI=1S/C16H16O4/c1-17-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)16(18-2)20-19-15/h3-10,15-16H,1-2H3
InChIKey
OJAUEKPDFNTHFB-UHFFFAOYSA-N
Compound name
8,11-dimethoxy-9,10-dioxatricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.10486 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.11214 162.1
[M+Na]+ 295.09408 167.6
[M-H]- 271.09758 165.3
[M+NH4]+ 290.13868 169.3
[M+K]+ 311.06802 168.3
[M+H-H2O]+ 255.10212 157.8
[M+HCOO]- 317.10306 170.3
[M+CH3COO]- 331.11871 167.0
[M+Na-2H]- 293.07953 163.6
[M]+ 272.10431 164.0
[M]- 272.10541 164.0
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.