CID 68310087

2-(3-aminocyclobutyl)propan-2-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
CC(C)(C1CC(C1)N)O
InChI
InChI=1S/C7H15NO/c1-7(2,9)5-3-6(8)4-5/h5-6,9H,3-4,8H2,1-2H3
InChIKey
YIHPWULVQBWRRH-UHFFFAOYSA-N
Compound name
2-(3-aminocyclobutyl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

129.11537 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 129.8
[M+Na]+ 152.10459 134.9
[M-H]- 128.10809 131.7
[M+NH4]+ 147.14919 144.5
[M+K]+ 168.07853 136.9
[M+H-H2O]+ 112.11263 120.2
[M+HCOO]- 174.11357 149.0
[M+CH3COO]- 188.12922 176.6
[M+Na-2H]- 150.09004 134.4
[M]+ 129.11482 134.8
[M]- 129.11592 134.8
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