CID 9580346

2-methylbenzaldehyde azine

Structural Information

Molecular Formula
C16H16N2
SMILES
CC1=CC=CC=C1/C=N/N=C/C2=CC=CC=C2C
InChI
InChI=1S/C16H16N2/c1-13-7-3-5-9-15(13)11-17-18-12-16-10-6-4-8-14(16)2/h3-12H,1-2H3/b17-11+,18-12+
InChIKey
NCVDVHCGHMDCSY-JYFOCSDGSA-N
Compound name
(E)-1-(2-methylphenyl)-N-[(E)-(2-methylphenyl)methylideneamino]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.13135 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.13863 154.1
[M+Na]+ 259.12057 161.6
[M-H]- 235.12407 163.5
[M+NH4]+ 254.16517 172.8
[M+K]+ 275.09451 157.7
[M+H-H2O]+ 219.12861 145.6
[M+HCOO]- 281.12955 183.3
[M+CH3COO]- 295.14520 202.3
[M+Na-2H]- 257.10602 161.3
[M]+ 236.13080 155.4
[M]- 236.13190 155.4
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.