CID 207136

29218-25-5

Structural Information

Molecular Formula
C10H10ClNO3
SMILES
C1C(OC(=O)N1C2=CC=C(C=C2)Cl)CO
InChI
InChI=1S/C10H10ClNO3/c11-7-1-3-8(4-2-7)12-5-9(6-13)15-10(12)14/h1-4,9,13H,5-6H2
InChIKey
YHROXANOYKBTMD-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-5-(hydroxymethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

227.03493 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.042206 146.1
[M+Na]+ 250.024148 155.6
[M-H]- 226.027654 151.1
[M+NH4]+ 245.068753 163.7
[M+K]+ 265.998088 152.3
[M+H-H2O]+ 210.032190 140.2
[M+HCOO]- 272.033131 162.1
[M+CH3COO]- 286.048781 183.2
[M+Na-2H]- 248.009596 149.5
[M]+ 227.03438142 147.6
[M]- 227.03547858 147.6
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