CID 130515259

3-[1-(aminomethyl)cyclopropyl]propane-1,2-diol hydrochloride

Structural Information

Molecular Formula
C7H15NO2
SMILES
C1CC1(CC(CO)O)CN
InChI
InChI=1S/C7H15NO2/c8-5-7(1-2-7)3-6(10)4-9/h6,9-10H,1-5,8H2
InChIKey
XENNKFLSPKABHY-UHFFFAOYSA-N
Compound name
3-[1-(aminomethyl)cyclopropyl]propane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.11028 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 129.6
[M+Na]+ 168.09950 137.3
[M-H]- 144.10300 131.3
[M+NH4]+ 163.14410 146.3
[M+K]+ 184.07344 135.1
[M+H-H2O]+ 128.10754 125.5
[M+HCOO]- 190.10848 150.1
[M+CH3COO]- 204.12413 175.6
[M+Na-2H]- 166.08495 135.2
[M]+ 145.10973 129.9
[M]- 145.11083 129.9
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.