CID 10012139

Methyl 6-amino-2,3,4,5-tetrahydropyridine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C7H12N2O2
SMILES
COC(=O)C1CCC(=NC1)N
InChI
InChI=1S/C7H12N2O2/c1-11-7(10)5-2-3-6(8)9-4-5/h5H,2-4H2,1H3,(H2,8,9)
InChIKey
NDYOGNUJWRYXIH-UHFFFAOYSA-N
Compound name
methyl 6-amino-2,3,4,5-tetrahydropyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

11
Patents

156.08987 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.09715 132.6
[M+Na]+ 179.07909 138.9
[M-H]- 155.08259 134.2
[M+NH4]+ 174.12369 151.7
[M+K]+ 195.05303 138.3
[M+H-H2O]+ 139.08713 126.1
[M+HCOO]- 201.08807 153.7
[M+CH3COO]- 215.10372 177.3
[M+Na-2H]- 177.06454 137.2
[M]+ 156.08932 129.5
[M]- 156.09042 129.5
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