CID 219072

Lr 534

Structural Information

Molecular Formula
C15H19FN2O2
SMILES
CCN(CC)CCC1=C(NC(=O)O1)C2=CC=C(C=C2)F
InChI
InChI=1S/C15H19FN2O2/c1-3-18(4-2)10-9-13-14(17-15(19)20-13)11-5-7-12(16)8-6-11/h5-8H,3-4,9-10H2,1-2H3,(H,17,19)
InChIKey
RRKXWTIXDRQLHE-UHFFFAOYSA-N
Compound name
5-[2-(diethylamino)ethyl]-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

278.14307 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.15035 165.8
[M+Na]+ 301.13229 177.2
[M+NH4]+ 296.17689 172.1
[M+K]+ 317.10623 172.8
[M-H]- 277.13579 168.7
[M+Na-2H]- 299.11774 171.0
[M]+ 278.14252 168.0
[M]- 278.14362 168.0
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