CID 25345631

3-(3-aminophenyl)-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C9H10N2O2
SMILES
C1COC(=O)N1C2=CC=CC(=C2)N
InChI
InChI=1S/C9H10N2O2/c10-7-2-1-3-8(6-7)11-4-5-13-9(11)12/h1-3,6H,4-5,10H2
InChIKey
XUGIHVFCZIFYHH-UHFFFAOYSA-N
Compound name
3-(3-aminophenyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

178.07423 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.08151 135.6
[M+Na]+ 201.06345 143.5
[M-H]- 177.06695 141.4
[M+NH4]+ 196.10805 154.2
[M+K]+ 217.03739 142.2
[M+H-H2O]+ 161.07149 128.6
[M+HCOO]- 223.07243 158.4
[M+CH3COO]- 237.08808 179.9
[M+Na-2H]- 199.04890 140.6
[M]+ 178.07368 133.2
[M]- 178.07478 133.2
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