CID 26183385

915919-73-2

Structural Information

Molecular Formula
C15H10N2O
SMILES
C1=CC=C2C(=C1)C=CC=C2C3=NC=C(C=N3)C=O
InChI
InChI=1S/C15H10N2O/c18-10-11-8-16-15(17-9-11)14-7-3-5-12-4-1-2-6-13(12)14/h1-10H
InChIKey
PFXITZIWRQYRTP-UHFFFAOYSA-N
Compound name
2-naphthalen-1-ylpyrimidine-5-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

234.07932 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.08660 151.4
[M+Na]+ 257.06854 161.2
[M-H]- 233.07204 156.5
[M+NH4]+ 252.11314 167.3
[M+K]+ 273.04248 155.7
[M+H-H2O]+ 217.07658 142.0
[M+HCOO]- 279.07752 172.9
[M+CH3COO]- 293.09317 163.9
[M+Na-2H]- 255.05399 160.7
[M]+ 234.07877 151.9
[M]- 234.07987 151.9
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

No patent data available for this compound.