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]+ 335.10665 176.1
[M+Na]+ 357.08859 187.5
[M-H]- 333.09209 181.4
[M+NH4]+ 352.13319 193.7
[M+K]+ 373.06253 179.4
[M+H-H2O]+ 317.09663 166.3
[M+HCOO]- 379.09757 191.9
[M+CH3COO]- 393.11322 187.0
[M+Na-2H]- 355.07404 187.2
[M]+ 334.09882 180.4
[M]- 334.09992 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.