CID 83250910

3-(cyclopropylmethyl)imidazolidin-4-one

Structural Information

Molecular Formula
C7H12N2O
SMILES
C1CC1CN2CNCC2=O
InChI
InChI=1S/C7H12N2O/c10-7-3-8-5-9(7)4-6-1-2-6/h6,8H,1-5H2
InChIKey
QQJAYHXFBZQHJE-UHFFFAOYSA-N
Compound name
3-(cyclopropylmethyl)imidazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.09496 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.10224 134.7
[M+Na]+ 163.08418 143.6
[M-H]- 139.08768 137.9
[M+NH4]+ 158.12878 149.7
[M+K]+ 179.05812 140.1
[M+H-H2O]+ 123.09222 127.3
[M+HCOO]- 185.09316 154.3
[M+CH3COO]- 199.10881 173.5
[M+Na-2H]- 161.06963 138.2
[M]+ 140.09441 133.1
[M]- 140.09551 133.1
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.