CID 624785

Anhydrovariabilin

Structural Information

Molecular Formula
C17H14O4
SMILES
COC1=CC2=C(C=C1)C3=C(O2)C4=C(C=C(C=C4)OC)OC3
InChI
InChI=1S/C17H14O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8H,9H2,1-2H3
InChIKey
FLEXCYTURSFUNC-UHFFFAOYSA-N
Compound name
3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

21
Patents

282.0892 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.096476 159.6
[M+Na]+ 305.078418 171.2
[M-H]- 281.081924 168.4
[M+NH4]+ 300.123023 178.3
[M+K]+ 321.052358 169.8
[M+H-H2O]+ 265.086460 153.3
[M+HCOO]- 327.087401 180.4
[M+CH3COO]- 341.103051 173.7
[M+Na-2H]- 303.063866 168.3
[M]+ 282.08865142 167.7
[M]- 282.08974858 167.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe