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]+ 248.11823 154.6
[M+Na]+ 270.10017 161.6
[M-H]- 246.10367 161.5
[M+NH4]+ 265.14477 170.9
[M+K]+ 286.07411 156.5
[M+H-H2O]+ 230.10821 145.4
[M+HCOO]- 292.10915 179.0
[M+CH3COO]- 306.12480 166.6
[M+Na-2H]- 268.08562 163.5
[M]+ 247.11040 152.1
[M]- 247.11150 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