CID 6447277

73043-46-6

Structural Information

Molecular Formula
C15H16N2O4
SMILES
CC1=N/C(=C/C2=CC=C(C=C2)OC)/C(=O)N1CCC(=O)O
InChI
InChI=1S/C15H16N2O4/c1-10-16-13(15(20)17(10)8-7-14(18)19)9-11-3-5-12(21-2)6-4-11/h3-6,9H,7-8H2,1-2H3,(H,18,19)/b13-9+
InChIKey
IWKCRTBEKUFURK-UKTHLTGXSA-N
Compound name
3-[(4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.111 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.11828 167.3
[M+Na]+ 311.10022 178.3
[M+NH4]+ 306.14482 172.0
[M+K]+ 327.07416 175.2
[M-H]- 287.10372 167.2
[M+Na-2H]- 309.08567 170.9
[M]+ 288.11045 168.4
[M]- 288.11155 168.4
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.