CID 49804

67323-61-9

Structural Information

Molecular Formula
C18H23N3O4
SMILES
CC1CC(C(=O)O1)(CC=C)C(=O)NC(=O)NC2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C18H23N3O4/c1-5-10-18(11-12(2)25-16(18)23)15(22)20-17(24)19-13-6-8-14(9-7-13)21(3)4/h5-9,12H,1,10-11H2,2-4H3,(H2,19,20,22,24)
InChIKey
UOHMNMUUQPDKQL-UHFFFAOYSA-N
Compound name
N-[[4-(dimethylamino)phenyl]carbamoyl]-5-methyl-2-oxo-3-prop-2-enyloxolane-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.16885 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.17613 183.0
[M+Na]+ 368.15807 189.5
[M+NH4]+ 363.20267 188.7
[M+K]+ 384.13201 186.0
[M-H]- 344.16157 186.4
[M+Na-2H]- 366.14352 186.8
[M]+ 345.16830 184.4
[M]- 345.16940 184.4
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.