CID 624492

9-(phenyliminomethyl)anthracene

Structural Information

Molecular Formula
C21H15N
SMILES
C1=CC=C(C=C1)N=CC2=C3C=CC=CC3=CC4=CC=CC=C42
InChI
InChI=1S/C21H15N/c1-2-10-18(11-3-1)22-15-21-19-12-6-4-8-16(19)14-17-9-5-7-13-20(17)21/h1-15H
InChIKey
OJJWOWZJUYHCPD-UHFFFAOYSA-N
Compound name
1-anthracen-9-yl-N-phenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

281.12045 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.127726 164.0
[M+Na]+ 304.109668 173.1
[M-H]- 280.113174 173.7
[M+NH4]+ 299.154273 181.9
[M+K]+ 320.083608 166.1
[M+H-H2O]+ 264.117710 154.6
[M+HCOO]- 326.118651 189.4
[M+CH3COO]- 340.134301 176.7
[M+Na-2H]- 302.095116 174.7
[M]+ 281.11990142 165.1
[M]- 281.12099858 165.1
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.