CID 165789465

2110748-16-6

Structural Information

Molecular Formula
C8H10N2O2
SMILES
COC(=O)C1=C2CCCN2C=N1
InChI
InChI=1S/C8H10N2O2/c1-12-8(11)7-6-3-2-4-10(6)5-9-7/h5H,2-4H2,1H3
InChIKey
CVSJIKYOGDHYBO-UHFFFAOYSA-N
Compound name
methyl 6,7-dihydro-5H-pyrrolo[1,2-c]imidazole-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.07423 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08151 134.5
[M+Na]+ 189.06345 143.4
[M-H]- 165.06695 136.7
[M+NH4]+ 184.10805 157.0
[M+K]+ 205.03739 142.6
[M+H-H2O]+ 149.07149 128.1
[M+HCOO]- 211.07243 156.4
[M+CH3COO]- 225.08808 176.4
[M+Na-2H]- 187.04890 138.2
[M]+ 166.07368 135.8
[M]- 166.07478 135.8
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

No patent data available for this compound.