CID 211774

Nicotinamidine, n-1-naphthyl-

Structural Information

Molecular Formula
C16H13N3
SMILES
C1=CC=C2C(=C1)C=CC=C2N=C(C3=CN=CC=C3)N
InChI
InChI=1S/C16H13N3/c17-16(13-7-4-10-18-11-13)19-15-9-3-6-12-5-1-2-8-14(12)15/h1-11H,(H2,17,19)
InChIKey
LPQHYKPAQKVZKN-UHFFFAOYSA-N
Compound name
N'-naphthalen-1-ylpyridine-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

247.11095 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.118226 154.6
[M+Na]+ 270.100168 161.6
[M-H]- 246.103674 161.5
[M+NH4]+ 265.144773 170.9
[M+K]+ 286.074108 156.5
[M+H-H2O]+ 230.108210 145.4
[M+HCOO]- 292.109151 179.0
[M+CH3COO]- 306.124801 166.6
[M+Na-2H]- 268.085616 163.5
[M]+ 247.11040142 152.1
[M]- 247.11149858 152.1
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

patents stripe