CID 4200133

56181-32-9

Structural Information

Molecular Formula
C23H20
SMILES
CC1=CC=C(C2=C(C3=CC=CC=C3C=C12)CC4=CC=CC=C4)C
InChI
InChI=1S/C23H20/c1-16-12-13-17(2)23-21(16)15-19-10-6-7-11-20(19)22(23)14-18-8-4-3-5-9-18/h3-13,15H,14H2,1-2H3
InChIKey
DYZQWZGGOBFCDM-UHFFFAOYSA-N
Compound name
9-benzyl-1,4-dimethylanthracene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.1565 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.16378 171.5
[M+Na]+ 319.14572 181.6
[M-H]- 295.14922 180.4
[M+NH4]+ 314.19032 189.0
[M+K]+ 335.11966 174.0
[M+H-H2O]+ 279.15376 162.5
[M+HCOO]- 341.15470 193.4
[M+CH3COO]- 355.17035 183.8
[M+Na-2H]- 317.13117 178.5
[M]+ 296.15595 173.6
[M]- 296.15705 173.6
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.