CID 21515090

2-(cyclobutylamino)ethan-1-ol

Structural Information

Molecular Formula
C6H13NO
SMILES
C1CC(C1)NCCO
InChI
InChI=1S/C6H13NO/c8-5-4-7-6-2-1-3-6/h6-8H,1-5H2
InChIKey
KYRHCYMKJGANFI-UHFFFAOYSA-N
Compound name
2-(cyclobutylamino)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

136
Patents

115.09972 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.0
[M+Na]+ 138.08894 127.1
[M-H]- 114.09244 124.8
[M+NH4]+ 133.13354 138.0
[M+K]+ 154.06288 129.4
[M+H-H2O]+ 98.096980 112.6
[M+HCOO]- 160.09792 144.7
[M+CH3COO]- 174.11357 173.0
[M+Na-2H]- 136.07439 129.4
[M]+ 115.09917 128.7
[M]- 115.10027 128.7
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