CID 45049213

Alpha,3-bis-(phenylcarbamoyl)-2-methyleneoxazolidine

Structural Information

Molecular Formula
C18H17N3O3
SMILES
C1CO/C(=C/C(=O)NC2=CC=CC=C2)/N1C(=O)NC3=CC=CC=C3
InChI
InChI=1S/C18H17N3O3/c22-16(19-14-7-3-1-4-8-14)13-17-21(11-12-24-17)18(23)20-15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H,19,22)(H,20,23)/b17-13+
InChIKey
RTAHHRRUGKXYIZ-GHRIWEEISA-N
Compound name
(2E)-2-(2-anilino-2-oxoethylidene)-N-phenyl-1,3-oxazolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.12698 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.13426 175.5
[M+Na]+ 346.11620 178.9
[M-H]- 322.11970 183.9
[M+NH4]+ 341.16080 187.0
[M+K]+ 362.09014 175.9
[M+H-H2O]+ 306.12424 165.8
[M+HCOO]- 368.12518 196.8
[M+CH3COO]- 382.14083 207.5
[M+Na-2H]- 344.10165 178.0
[M]+ 323.12643 172.0
[M]- 323.12753 172.0
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

No patent data available for this compound.