CID 105435214

3-(3-aminopropyl)-5,5-dimethyl-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CC1(CN(C(=O)O1)CCCN)C
InChI
InChI=1S/C8H16N2O2/c1-8(2)6-10(5-3-4-9)7(11)12-8/h3-6,9H2,1-2H3
InChIKey
VVYUBXBJUSQIRZ-UHFFFAOYSA-N
Compound name
3-(3-aminopropyl)-5,5-dimethyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.12119 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 136.4
[M+Na]+ 195.11041 144.2
[M-H]- 171.11391 138.9
[M+NH4]+ 190.15501 157.7
[M+K]+ 211.08435 144.1
[M+H-H2O]+ 155.11845 131.3
[M+HCOO]- 217.11939 157.9
[M+CH3COO]- 231.13504 180.9
[M+Na-2H]- 193.09586 141.0
[M]+ 172.12064 136.3
[M]- 172.12174 136.3
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.