CID 28740412

3-[3-(aminomethyl)phenyl]-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C10H12N2O2
SMILES
C1COC(=O)N1C2=CC=CC(=C2)CN
InChI
InChI=1S/C10H12N2O2/c11-7-8-2-1-3-9(6-8)12-4-5-14-10(12)13/h1-3,6H,4-5,7,11H2
InChIKey
CSHIRRDTCOQWTI-UHFFFAOYSA-N
Compound name
3-[3-(aminomethyl)phenyl]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

192.08987 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.09715 141.3
[M+Na]+ 215.07909 152.6
[M+NH4]+ 210.12369 149.1
[M+K]+ 231.05303 149.1
[M-H]- 191.08259 145.5
[M+Na-2H]- 213.06454 147.1
[M]+ 192.08932 143.8
[M]- 192.09042 143.8
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

patents stripe