CID 115064419

4-(aminomethyl)-4-methyl-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C5H10N2O2
SMILES
CC1(COC(=O)N1)CN
InChI
InChI=1S/C5H10N2O2/c1-5(2-6)3-9-4(8)7-5/h2-3,6H2,1H3,(H,7,8)
InChIKey
GPUZXRISKZMMQG-UHFFFAOYSA-N
Compound name
4-(aminomethyl)-4-methyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

130.07423 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.08151 124.3
[M+Na]+ 153.06345 132.0
[M-H]- 129.06695 125.5
[M+NH4]+ 148.10805 146.2
[M+K]+ 169.03739 131.8
[M+H-H2O]+ 113.07149 119.5
[M+HCOO]- 175.07243 145.2
[M+CH3COO]- 189.08808 168.0
[M+Na-2H]- 151.04890 130.6
[M]+ 130.07368 120.9
[M]- 130.07478 120.9
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

patents stripe