CID 80487110

3-amino-1-cyclobutyl-2,2-dimethylpropan-1-ol

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)(CN)C(C1CCC1)O
InChI
InChI=1S/C9H19NO/c1-9(2,6-10)8(11)7-4-3-5-7/h7-8,11H,3-6,10H2,1-2H3
InChIKey
IUEIUGLPTBDOOG-UHFFFAOYSA-N
Compound name
3-amino-1-cyclobutyl-2,2-dimethylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 140.7
[M+Na]+ 180.135888 143.7
[M-H]- 156.139394 141.9
[M+NH4]+ 175.180493 153.8
[M+K]+ 196.109828 145.7
[M+H-H2O]+ 140.143930 130.4
[M+HCOO]- 202.144871 158.2
[M+CH3COO]- 216.160521 182.3
[M+Na-2H]- 178.121336 143.5
[M]+ 157.14612142 145.3
[M]- 157.14721858 145.3
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.