CID 79134761

4-[1-(aminomethyl)cyclobutyl]oxan-4-ol

Structural Information

Molecular Formula
C10H19NO2
SMILES
C1CC(C1)(CN)C2(CCOCC2)O
InChI
InChI=1S/C10H19NO2/c11-8-9(2-1-3-9)10(12)4-6-13-7-5-10/h12H,1-8,11H2
InChIKey
DBNHEUOIODHIEB-UHFFFAOYSA-N
Compound name
4-[1-(aminomethyl)cyclobutyl]oxan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.14159 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14887 141.4
[M+Na]+ 208.13081 144.2
[M-H]- 184.13431 146.0
[M+NH4]+ 203.17541 155.6
[M+K]+ 224.10475 146.8
[M+H-H2O]+ 168.13885 131.9
[M+HCOO]- 230.13979 157.9
[M+CH3COO]- 244.15544 182.1
[M+Na-2H]- 206.11626 147.6
[M]+ 185.14104 143.9
[M]- 185.14214 143.9
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.