CID 20836258

Brn 3556078

Structural Information

Molecular Formula
C17H12N2O3
SMILES
C1=CC=C(C=C1)C(=O)/C=C/2\C(=O)N(C(=N)O2)C3=CC=CC=C3
InChI
InChI=1S/C17H12N2O3/c18-17-19(13-9-5-2-6-10-13)16(21)15(22-17)11-14(20)12-7-3-1-4-8-12/h1-11,18H/b15-11+,18-17?
InChIKey
AOYABZCEEQDHLQ-SQONSMICSA-N
Compound name
(5E)-2-imino-5-phenacylidene-3-phenyl-1,3-oxazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.08478 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.09206 167.2
[M+Na]+ 315.07400 180.0
[M+NH4]+ 310.11860 173.7
[M+K]+ 331.04794 175.5
[M-H]- 291.07750 172.9
[M+Na-2H]- 313.05945 174.5
[M]+ 292.08423 170.3
[M]- 292.08533 170.3
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.