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]+ 173.128466 136.4
[M+Na]+ 195.110408 144.2
[M-H]- 171.113914 138.9
[M+NH4]+ 190.155013 157.7
[M+K]+ 211.084348 144.1
[M+H-H2O]+ 155.118450 131.3
[M+HCOO]- 217.119391 157.9
[M+CH3COO]- 231.135041 180.9
[M+Na-2H]- 193.095856 141.0
[M]+ 172.12064142 136.3
[M]- 172.12173858 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.