CID 3843096

N-(9-anthracenylmethylene)-m-anisidine

Structural Information

Molecular Formula
C22H17NO
SMILES
COC1=CC=CC(=C1)N=CC2=C3C=CC=CC3=CC4=CC=CC=C42
InChI
InChI=1S/C22H17NO/c1-24-19-10-6-9-18(14-19)23-15-22-20-11-4-2-7-16(20)13-17-8-3-5-12-21(17)22/h2-15H,1H3
InChIKey
PIZCGTWWUXHKQT-UHFFFAOYSA-N
Compound name
1-anthracen-9-yl-N-(3-methoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

311.131 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.13828 172.9
[M+Na]+ 334.12022 182.2
[M-H]- 310.12372 182.8
[M+NH4]+ 329.16482 189.7
[M+K]+ 350.09416 175.8
[M+H-H2O]+ 294.12826 163.1
[M+HCOO]- 356.12920 198.0
[M+CH3COO]- 370.14485 185.2
[M+Na-2H]- 332.10567 182.2
[M]+ 311.13045 176.0
[M]- 311.13155 176.0
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.