CID 630189

1-chloro-9,10-diphenylanthracene

Structural Information

Molecular Formula
C26H17Cl
SMILES
C1=CC=C(C=C1)C2=C3C=CC=C(C3=C(C4=CC=CC=C42)C5=CC=CC=C5)Cl
InChI
InChI=1S/C26H17Cl/c27-23-17-9-16-22-24(18-10-3-1-4-11-18)20-14-7-8-15-21(20)25(26(22)23)19-12-5-2-6-13-19/h1-17H
InChIKey
VVCSLEYASKOQEN-UHFFFAOYSA-N
Compound name
1-chloro-9,10-diphenylanthracene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

364.10187 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.10915 188.7
[M+Na]+ 387.09109 199.4
[M-H]- 363.09459 199.7
[M+NH4]+ 382.13569 203.3
[M+K]+ 403.06503 189.4
[M+H-H2O]+ 347.09913 178.2
[M+HCOO]- 409.10007 205.8
[M+CH3COO]- 423.11572 199.6
[M+Na-2H]- 385.07654 195.4
[M]+ 364.10132 191.4
[M]- 364.10242 191.4
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