CID 45903

N-ethyl-4-methoxy-n-(o-tolyl)-1-naphthamidine hydrochloride

Structural Information

Molecular Formula
C21H22N2O
SMILES
CCN(C1=CC=CC=C1C)C(=N)C2=CC=C(C3=CC=CC=C32)OC
InChI
InChI=1S/C21H22N2O/c1-4-23(19-12-8-5-9-15(19)2)21(22)18-13-14-20(24-3)17-11-7-6-10-16(17)18/h5-14,22H,4H2,1-3H3
InChIKey
ATWMQEQEGAPVMM-UHFFFAOYSA-N
Compound name
N-ethyl-4-methoxy-N-(2-methylphenyl)naphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.17322 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.18050 177.3
[M+Na]+ 341.16244 183.3
[M-H]- 317.16594 186.0
[M+NH4]+ 336.20704 192.6
[M+K]+ 357.13638 179.1
[M+H-H2O]+ 301.17048 168.1
[M+HCOO]- 363.17142 200.9
[M+CH3COO]- 377.18707 218.8
[M+Na-2H]- 339.14789 181.4
[M]+ 318.17267 178.5
[M]- 318.17377 178.5
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

No patent data available for this compound.