CID 53350387

Ethyl 5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C11H14N2O2
SMILES
CCOC(=O)C1=CC2=C(CNCC2)N=C1
InChI
InChI=1S/C11H14N2O2/c1-2-15-11(14)9-5-8-3-4-12-7-10(8)13-6-9/h5-6,12H,2-4,7H2,1H3
InChIKey
ZGZPRTMUGJTCMS-UHFFFAOYSA-N
Compound name
ethyl 5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

206.10553 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.112806 145.6
[M+Na]+ 229.094748 152.1
[M-H]- 205.098254 145.4
[M+NH4]+ 224.139353 162.0
[M+K]+ 245.068688 149.0
[M+H-H2O]+ 189.102790 138.0
[M+HCOO]- 251.103731 162.0
[M+CH3COO]- 265.119381 182.8
[M+Na-2H]- 227.080196 151.7
[M]+ 206.10498142 143.1
[M]- 206.10607858 143.1
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