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

1
Patents

177.07898 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08626 136.1
[M+Na]+ 200.06820 144.1
[M-H]- 176.07170 141.0
[M+NH4]+ 195.11280 154.7
[M+K]+ 216.04214 142.2
[M+H-H2O]+ 160.07624 129.7
[M+HCOO]- 222.07718 156.7
[M+CH3COO]- 236.09283 176.0
[M+Na-2H]- 198.05365 140.7
[M]+ 177.07843 133.9
[M]- 177.07953 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