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]+ 158.15395 140.7
[M+Na]+ 180.13589 143.7
[M-H]- 156.13939 141.9
[M+NH4]+ 175.18049 153.8
[M+K]+ 196.10983 145.7
[M+H-H2O]+ 140.14393 130.4
[M+HCOO]- 202.14487 158.2
[M+CH3COO]- 216.16052 182.3
[M+Na-2H]- 178.12134 143.5
[M]+ 157.14612 145.3
[M]- 157.14722 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.