CID 28987

Of-2440

Structural Information

Molecular Formula
C24H30N2O2
SMILES
CCN(CC)CCOC1=CC2=C(C=C1)N(C(=C2C(=O)C)C)C3=CC=C(C=C3)C
InChI
InChI=1S/C24H30N2O2/c1-6-25(7-2)14-15-28-21-12-13-23-22(16-21)24(19(5)27)18(4)26(23)20-10-8-17(3)9-11-20/h8-13,16H,6-7,14-15H2,1-5H3
InChIKey
AHAGQPIPYRQMPB-UHFFFAOYSA-N
Compound name
1-[5-[2-(diethylamino)ethoxy]-2-methyl-1-(4-methylphenyl)indol-3-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.23074 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.238016 196.3
[M+Na]+ 401.219958 204.2
[M-H]- 377.223464 204.3
[M+NH4]+ 396.264563 210.6
[M+K]+ 417.193898 199.7
[M+H-H2O]+ 361.228000 186.9
[M+HCOO]- 423.228941 218.8
[M+CH3COO]- 437.244591 229.8
[M+Na-2H]- 399.205406 195.2
[M]+ 378.23019142 204.2
[M]- 378.23128858 204.2
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.