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]+ 146.117556 134.1
[M+Na]+ 168.099498 138.9
[M-H]- 144.103004 134.6
[M+NH4]+ 163.144103 149.1
[M+K]+ 184.073438 140.2
[M+H-H2O]+ 128.107540 125.1
[M+HCOO]- 190.108481 153.5
[M+CH3COO]- 204.124131 175.5
[M+Na-2H]- 166.084946 138.6
[M]+ 145.10973142 139.4
[M]- 145.11082858 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.