CID 624658

9-isopropyl-10-phenyl-anthracene

Structural Information

Molecular Formula
C23H20
SMILES
CC(C)C1=C2C=CC=CC2=C(C3=CC=CC=C31)C4=CC=CC=C4
InChI
InChI=1S/C23H20/c1-16(2)22-18-12-6-8-14-20(18)23(17-10-4-3-5-11-17)21-15-9-7-13-19(21)22/h3-16H,1-2H3
InChIKey
JBJZABACKJFZIG-UHFFFAOYSA-N
Compound name
9-phenyl-10-propan-2-ylanthracene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
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 171.4
[M+Na]+ 319.14572 180.1
[M-H]- 295.14922 179.9
[M+NH4]+ 314.19032 188.5
[M+K]+ 335.11966 173.1
[M+H-H2O]+ 279.15376 162.4
[M+HCOO]- 341.15470 192.3
[M+CH3COO]- 355.17035 183.2
[M+Na-2H]- 317.13117 178.0
[M]+ 296.15595 172.5
[M]- 296.15705 172.5
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

patents stripe