CID 71758501

Methyl 6-(aminomethyl)-2-cyclopropylpyridine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C11H14N2O2
SMILES
COC(=O)C1=C(N=C(C=C1)CN)C2CC2
InChI
InChI=1S/C11H14N2O2/c1-15-11(14)9-5-4-8(6-12)13-10(9)7-2-3-7/h4-5,7H,2-3,6,12H2,1H3
InChIKey
MRPCEGKCMQJPJU-UHFFFAOYSA-N
Compound name
methyl 6-(aminomethyl)-2-cyclopropylpyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.10553 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.112806 146.4
[M+Na]+ 229.094748 156.0
[M-H]- 205.098254 152.5
[M+NH4]+ 224.139353 159.1
[M+K]+ 245.068688 152.3
[M+H-H2O]+ 189.102790 139.0
[M+HCOO]- 251.103731 169.7
[M+CH3COO]- 265.119381 191.3
[M+Na-2H]- 227.080196 150.7
[M]+ 206.10498142 149.2
[M]- 206.10607858 149.2
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.