CID 146049243

2411288-03-2

Structural Information

Molecular Formula
C11H14N2O2
SMILES
CC1=C(C=C2CCCNC2=N1)C(=O)OC
InChI
InChI=1S/C11H14N2O2/c1-7-9(11(14)15-2)6-8-4-3-5-12-10(8)13-7/h6H,3-5H2,1-2H3,(H,12,13)
InChIKey
DWTKQINOSRVUQO-UHFFFAOYSA-N
Compound name
methyl 2-methyl-5,6,7,8-tetrahydro-1,8-naphthyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.10553 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.112806 145.7
[M+Na]+ 229.094748 153.1
[M-H]- 205.098254 145.9
[M+NH4]+ 224.139353 162.5
[M+K]+ 245.068688 150.1
[M+H-H2O]+ 189.102790 138.4
[M+HCOO]- 251.103731 162.1
[M+CH3COO]- 265.119381 184.0
[M+Na-2H]- 227.080196 151.0
[M]+ 206.10498142 143.7
[M]- 206.10607858 143.7
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

No patent data available for this compound.