CID 207132

29218-21-1

Structural Information

Molecular Formula
C10H11NO3
SMILES
C1C(OC(=O)N1C2=CC=CC=C2)CO
InChI
InChI=1S/C10H11NO3/c12-7-9-6-11(10(13)14-9)8-4-2-1-3-5-8/h1-5,9,12H,6-7H2
InChIKey
WHXUEJAEOKJMAD-UHFFFAOYSA-N
Compound name
5-(hydroxymethyl)-3-phenyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

79
Patents

193.0739 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.08118 139.0
[M+Na]+ 216.06312 146.8
[M-H]- 192.06662 143.8
[M+NH4]+ 211.10772 156.8
[M+K]+ 232.03706 145.4
[M+H-H2O]+ 176.07116 132.4
[M+HCOO]- 238.07210 159.7
[M+CH3COO]- 252.08775 178.2
[M+Na-2H]- 214.04857 143.7
[M]+ 193.07335 138.2
[M]- 193.07445 138.2
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