CID 15418687

Ns00116678

Structural Information

Molecular Formula
C24H14O2
SMILES
C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C2C6=C(C=C5C=C4)C(=C(C=C6)O)O
InChI
InChI=1S/C24H14O2/c25-20-11-10-18-19(24(20)26)12-14-9-8-13-4-3-7-16-15-5-1-2-6-17(15)23(18)22(14)21(13)16/h1-12,25-26H
InChIKey
MIKPSGCFJZJLRS-UHFFFAOYSA-N
Compound name
hexacyclo[10.10.2.02,7.08,24.015,23.017,22]tetracosa-1(23),2,4,6,8,10,12(24),13,15,17(22),18,20-dodecaene-18,19-diol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

0
Patents

334.09937 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.106646 176.1
[M+Na]+ 357.088588 187.5
[M-H]- 333.092094 181.4
[M+NH4]+ 352.133193 193.7
[M+K]+ 373.062528 179.4
[M+H-H2O]+ 317.096630 166.3
[M+HCOO]- 379.097571 191.9
[M+CH3COO]- 393.113221 187.0
[M+Na-2H]- 355.074036 187.2
[M]+ 334.09882142 180.4
[M]- 334.09991858 180.4
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

No patent data available for this compound.