CID 22408680

3-(aminomethyl)cyclobutanol

Structural Information

Molecular Formula
C5H11NO
SMILES
C1C(CC1O)CN
InChI
InChI=1S/C5H11NO/c6-3-4-1-5(7)2-4/h4-5,7H,1-3,6H2
InChIKey
KOAINJWHBAJGSO-UHFFFAOYSA-N
Compound name
3-(aminomethyl)cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

244
Patents

101.08406 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.09134 120.4
[M+Na]+ 124.07328 125.5
[M+NH4]+ 119.11788 124.9
[M+K]+ 140.04722 122.7
[M-H]- 100.07678 118.9
[M+Na-2H]- 122.05873 122.3
[M]+ 101.08351 119.2
[M]- 101.08461 119.2
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

patents stripe