CID 3046891

5-(p-fluorobenzyl)-2-oxazolidone

Structural Information

Molecular Formula
C10H10FNO2
SMILES
C1C(OC(=O)N1)CC2=CC=C(C=C2)F
InChI
InChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)5-9-6-12-10(13)14-9/h1-4,9H,5-6H2,(H,12,13)
InChIKey
YJQGCMLOVNBRLI-UHFFFAOYSA-N
Compound name
5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

195.06955 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07683 138.8
[M+Na]+ 218.05877 146.8
[M-H]- 194.06227 142.2
[M+NH4]+ 213.10337 156.6
[M+K]+ 234.03271 144.4
[M+H-H2O]+ 178.06681 131.4
[M+HCOO]- 240.06775 158.3
[M+CH3COO]- 254.08340 178.7
[M+Na-2H]- 216.04422 142.8
[M]+ 195.06900 135.5
[M]- 195.07010 135.5
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