CID 76223488

2-amino-3-(1,3-dioxolan-2-yl)propan-1-ol

Structural Information

Molecular Formula
C6H13NO3
SMILES
C1COC(O1)CC(CO)N
InChI
InChI=1S/C6H13NO3/c7-5(4-8)3-6-9-1-2-10-6/h5-6,8H,1-4,7H2
InChIKey
WHNIIGYMYSUBCG-UHFFFAOYSA-N
Compound name
2-amino-3-(1,3-dioxolan-2-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.08954 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.09682 132.1
[M+Na]+ 170.07876 136.8
[M-H]- 146.08226 134.4
[M+NH4]+ 165.12336 150.8
[M+K]+ 186.05270 138.5
[M+H-H2O]+ 130.08680 126.7
[M+HCOO]- 192.08774 151.9
[M+CH3COO]- 206.10339 171.8
[M+Na-2H]- 168.06421 136.9
[M]+ 147.08899 129.8
[M]- 147.09009 129.8
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

No patent data available for this compound.