CID 1284728

N-(2-chlorobenzylidene)-4-anisidine

Structural Information

Molecular Formula
C14H12ClNO
SMILES
COC1=CC=C(C=C1)N=CC2=CC=CC=C2Cl
InChI
InChI=1S/C14H12ClNO/c1-17-13-8-6-12(7-9-13)16-10-11-4-2-3-5-14(11)15/h2-10H,1H3
InChIKey
LSBFMYAAXUQSLF-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)-N-(4-methoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

245.06075 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.06803 152.8
[M+Na]+ 268.04997 162.1
[M-H]- 244.05347 161.0
[M+NH4]+ 263.09457 171.6
[M+K]+ 284.02391 157.1
[M+H-H2O]+ 228.05801 145.8
[M+HCOO]- 290.05895 175.6
[M+CH3COO]- 304.07460 196.0
[M+Na-2H]- 266.03542 159.7
[M]+ 245.06020 156.7
[M]- 245.06130 156.7
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

patents stripe