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]+ 130.12265 130.9
[M+Na]+ 152.10459 134.2
[M-H]- 128.10809 132.1
[M+NH4]+ 147.14919 144.9
[M+K]+ 168.07853 136.4
[M+H-H2O]+ 112.11263 120.2
[M+HCOO]- 174.11357 150.6
[M+CH3COO]- 188.12922 176.1
[M+Na-2H]- 150.09004 134.2
[M]+ 129.11482 135.2
[M]- 129.11592 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.