CID 84071966

3-amino-2-cyclobutylpropan-1-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
C1CC(C1)C(CN)CO
InChI
InChI=1S/C7H15NO/c8-4-7(5-9)6-2-1-3-6/h6-7,9H,1-5,8H2
InChIKey
GRJHMWTZZXNXDB-UHFFFAOYSA-N
Compound name
3-amino-2-cyclobutylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 130.9
[M+Na]+ 152.104588 134.2
[M-H]- 128.108094 132.1
[M+NH4]+ 147.149193 144.9
[M+K]+ 168.078528 136.4
[M+H-H2O]+ 112.112630 120.2
[M+HCOO]- 174.113571 150.6
[M+CH3COO]- 188.129221 176.1
[M+Na-2H]- 150.090036 134.2
[M]+ 129.11482142 135.2
[M]- 129.11591858 135.2
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.