CID 2768491

900019-50-3

Structural Information

Molecular Formula
C10H11NO3
SMILES
COC(=O)C1=CC(=CN1)C(=O)C2CC2
InChI
InChI=1S/C10H11NO3/c1-14-10(13)8-4-7(5-11-8)9(12)6-2-3-6/h4-6,11H,2-3H2,1H3
InChIKey
ARKUXUKWKVFIBU-UHFFFAOYSA-N
Compound name
methyl 4-(cyclopropanecarbonyl)-1H-pyrrole-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.0739 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.08118 144.7
[M+Na]+ 216.06312 155.8
[M+NH4]+ 211.10772 151.9
[M+K]+ 232.03706 154.7
[M-H]- 192.06662 151.7
[M+Na-2H]- 214.04857 151.3
[M]+ 193.07335 149.0
[M]- 193.07445 149.0
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.