CID 76223818

1824191-75-4

Structural Information

Molecular Formula
C7H15NO2
SMILES
C1CC(C1CO)(CN)CO
InChI
InChI=1S/C7H15NO2/c8-4-7(5-10)2-1-6(7)3-9/h6,9-10H,1-5,8H2
InChIKey
VABNDAPWUVPQRM-UHFFFAOYSA-N
Compound name
[2-(aminomethyl)-2-(hydroxymethyl)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.11028 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 134.1
[M+Na]+ 168.09950 138.9
[M-H]- 144.10300 134.6
[M+NH4]+ 163.14410 149.1
[M+K]+ 184.07344 140.2
[M+H-H2O]+ 128.10754 125.1
[M+HCOO]- 190.10848 153.5
[M+CH3COO]- 204.12413 175.5
[M+Na-2H]- 166.08495 138.6
[M]+ 145.10973 139.4
[M]- 145.11083 139.4
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.