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

1
Patents

206.10553 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11281 145.6
[M+Na]+ 229.09475 152.1
[M-H]- 205.09825 145.4
[M+NH4]+ 224.13935 162.0
[M+K]+ 245.06869 149.0
[M+H-H2O]+ 189.10279 138.0
[M+HCOO]- 251.10373 162.0
[M+CH3COO]- 265.11938 182.8
[M+Na-2H]- 227.08020 151.7
[M]+ 206.10498 143.1
[M]- 206.10608 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