CID 15598716

111451-23-1

Structural Information

Molecular Formula
C18H15NO5
SMILES
CCOC(=O)ON=C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C18H15NO5/c1-2-23-18(22)24-19-15(16(20)13-9-5-3-6-10-13)17(21)14-11-7-4-8-12-14/h3-12H,2H2,1H3
InChIKey
VSWVIYVQOVAETC-UHFFFAOYSA-N
Compound name
[(1,3-dioxo-1,3-diphenylpropan-2-ylidene)amino] ethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

325.09503 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.10231 173.3
[M+Na]+ 348.08425 184.0
[M+NH4]+ 343.12885 178.6
[M+K]+ 364.05819 179.2
[M-H]- 324.08775 175.7
[M+Na-2H]- 346.06970 180.3
[M]+ 325.09448 175.1
[M]- 325.09558 175.1
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