CID 588884

3-methyl-1,5-naphthyridine

Structural Information

Molecular Formula
C9H8N2
SMILES
CC1=CC2=C(C=CC=N2)N=C1
InChI
InChI=1S/C9H8N2/c1-7-5-9-8(11-6-7)3-2-4-10-9/h2-6H,1H3
InChIKey
ABGOJEHSELXHTI-UHFFFAOYSA-N
Compound name
3-methyl-1,5-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

330
Patents

144.06874 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.07602 127.0
[M+Na]+ 167.05796 137.0
[M-H]- 143.06146 129.1
[M+NH4]+ 162.10256 147.1
[M+K]+ 183.03190 133.9
[M+H-H2O]+ 127.06600 119.7
[M+HCOO]- 189.06694 148.9
[M+CH3COO]- 203.08259 141.1
[M+Na-2H]- 165.04341 138.0
[M]+ 144.06819 127.1
[M]- 144.06929 127.1
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