CID 93693

57515-95-4

Structural Information

Molecular Formula
C18H20N2O2
SMILES
CN(C)C1=CC=C(C=C1)C2C3=C(C=C(C=C3)N(C)C)C(=O)O2
InChI
InChI=1S/C18H20N2O2/c1-19(2)13-7-5-12(6-8-13)17-15-10-9-14(20(3)4)11-16(15)18(21)22-17/h5-11,17H,1-4H3
InChIKey
TYIHCISAZQHKHT-UHFFFAOYSA-N
Compound name
6-(dimethylamino)-3-[4-(dimethylamino)phenyl]-3H-2-benzofuran-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

327
Patents

296.15247 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.15975 169.9
[M+Na]+ 319.14169 182.8
[M+NH4]+ 314.18629 178.7
[M+K]+ 335.11563 178.0
[M-H]- 295.14519 177.3
[M+Na-2H]- 317.12714 176.6
[M]+ 296.15192 173.9
[M]- 296.15302 173.9
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