CID 55229

Brn 3375122

Structural Information

Molecular Formula
C21H22N2O
SMILES
CC(C)OC1=CC=C(C=C1)N=C(C)NC2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C21H22N2O/c1-15(2)24-21-12-10-19(11-13-21)22-16(3)23-20-9-8-17-6-4-5-7-18(17)14-20/h4-15H,1-3H3,(H,22,23)
InChIKey
CMSIEHRMDUVLLB-UHFFFAOYSA-N
Compound name
N-naphthalen-2-yl-N'-(4-propan-2-yloxyphenyl)ethanimidamide
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 182.4
[M-H]- 317.16594 185.6
[M+NH4]+ 336.20704 192.4
[M+K]+ 357.13638 178.1
[M+H-H2O]+ 301.17048 168.0
[M+HCOO]- 363.17142 200.9
[M+CH3COO]- 377.18707 216.9
[M+Na-2H]- 339.14789 182.2
[M]+ 318.17267 177.9
[M]- 318.17377 177.9
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.