CID 68841216

Methyl 2-(6-aminopyridin-2-yl)acetate

Structural Information

Molecular Formula
C8H10N2O2
SMILES
COC(=O)CC1=NC(=CC=C1)N
InChI
InChI=1S/C8H10N2O2/c1-12-8(11)5-6-3-2-4-7(9)10-6/h2-4H,5H2,1H3,(H2,9,10)
InChIKey
KRADSNMMTKSJQC-UHFFFAOYSA-N
Compound name
methyl 2-(6-aminopyridin-2-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

166.07423 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08151 133.7
[M+Na]+ 189.06345 141.7
[M-H]- 165.06695 135.9
[M+NH4]+ 184.10805 152.6
[M+K]+ 205.03739 140.4
[M+H-H2O]+ 149.07149 127.0
[M+HCOO]- 211.07243 157.4
[M+CH3COO]- 225.08808 179.6
[M+Na-2H]- 187.04890 139.8
[M]+ 166.07368 133.8
[M]- 166.07478 133.8
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