CID 65453518

67118-33-6

Structural Information

Molecular Formula
C8H11NO3
SMILES
C1CC(=O)N(C1)C2(CC2)C(=O)O
InChI
InChI=1S/C8H11NO3/c10-6-2-1-5-9(6)8(3-4-8)7(11)12/h1-5H2,(H,11,12)
InChIKey
YNQNZCSAHNGORR-UHFFFAOYSA-N
Compound name
1-(2-oxopyrrolidin-1-yl)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.0739 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.08118 137.2
[M+Na]+ 192.06312 146.3
[M-H]- 168.06662 142.2
[M+NH4]+ 187.10772 154.2
[M+K]+ 208.03706 144.1
[M+H-H2O]+ 152.07116 132.2
[M+HCOO]- 214.07210 157.0
[M+CH3COO]- 228.08775 177.2
[M+Na-2H]- 190.04857 140.8
[M]+ 169.07335 137.6
[M]- 169.07445 137.6
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

No patent data available for this compound.