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]+ 235.086596 151.4
[M+Na]+ 257.068538 161.2
[M-H]- 233.072044 156.5
[M+NH4]+ 252.113143 167.3
[M+K]+ 273.042478 155.7
[M+H-H2O]+ 217.076580 142.0
[M+HCOO]- 279.077521 172.9
[M+CH3COO]- 293.093171 163.9
[M+Na-2H]- 255.053986 160.7
[M]+ 234.07877142 151.9
[M]- 234.07986858 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.