CID 137965934

2230799-56-9

Structural Information

Molecular Formula
C9H16N2O
SMILES
CC1(CN(C1=O)C2CCC2)CN
InChI
InChI=1S/C9H16N2O/c1-9(5-10)6-11(8(9)12)7-3-2-4-7/h7H,2-6,10H2,1H3
InChIKey
GEJCMOVXNKCCJT-UHFFFAOYSA-N
Compound name
3-(aminomethyl)-1-cyclobutyl-3-methylazetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.12627 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.13355 145.9
[M+Na]+ 191.11549 146.6
[M+NH4]+ 186.16009 146.9
[M+K]+ 207.08943 143.7
[M-H]- 167.11899 142.7
[M+Na-2H]- 189.10094 146.3
[M]+ 168.12572 142.8
[M]- 168.12682 142.8
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.