CID 79124685

1-[1-(aminomethyl)cyclobutyl]cyclobutan-1-ol

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC(C1)(CN)C2(CCC2)O
InChI
InChI=1S/C9H17NO/c10-7-8(3-1-4-8)9(11)5-2-6-9/h11H,1-7,10H2
InChIKey
UIRGZQQFLORBCF-UHFFFAOYSA-N
Compound name
1-[1-(aminomethyl)cyclobutyl]cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 143.0
[M+Na]+ 178.12023 142.8
[M+NH4]+ 173.16483 145.9
[M+K]+ 194.09417 138.4
[M-H]- 154.12373 140.3
[M+Na-2H]- 176.10568 145.1
[M]+ 155.13046 140.1
[M]- 155.13156 140.1
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.