CID 16085054

166182-90-7

Structural Information

Molecular Formula
C7H10N2O2
SMILES
CN1C(=CC=C1N)C(=O)OC
InChI
InChI=1S/C7H10N2O2/c1-9-5(7(10)11-2)3-4-6(9)8/h3-4H,8H2,1-2H3
InChIKey
CONOJFVXWDLLCO-UHFFFAOYSA-N
Compound name
methyl 5-amino-1-methylpyrrole-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

154.07423 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.08151 131.4
[M+Na]+ 177.06345 141.4
[M+NH4]+ 172.10805 138.6
[M+K]+ 193.03739 139.2
[M-H]- 153.06695 131.7
[M+Na-2H]- 175.04890 135.7
[M]+ 154.07368 132.6
[M]- 154.07478 132.6
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