CID 64985229

5-(3-methylphenyl)-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C10H11NO2
SMILES
CC1=CC(=CC=C1)C2CNC(=O)O2
InChI
InChI=1S/C10H11NO2/c1-7-3-2-4-8(5-7)9-6-11-10(12)13-9/h2-5,9H,6H2,1H3,(H,11,12)
InChIKey
LMHZGACSBRCTMO-UHFFFAOYSA-N
Compound name
5-(3-methylphenyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

177.07898 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.086256 136.1
[M+Na]+ 200.068198 144.1
[M-H]- 176.071704 141.0
[M+NH4]+ 195.112803 154.7
[M+K]+ 216.042138 142.2
[M+H-H2O]+ 160.076240 129.7
[M+HCOO]- 222.077181 156.7
[M+CH3COO]- 236.092831 176.0
[M+Na-2H]- 198.053646 140.7
[M]+ 177.07843142 133.9
[M]- 177.07952858 133.9
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