CID 37689

37129-53-6

Structural Information

Molecular Formula
C20H24N2O
SMILES
CCC1(C2=CC=CC=C2N(C1=O)CCNCC)C3=CC=CC=C3
InChI
InChI=1S/C20H24N2O/c1-3-20(16-10-6-5-7-11-16)17-12-8-9-13-18(17)22(19(20)23)15-14-21-4-2/h5-13,21H,3-4,14-15H2,1-2H3
InChIKey
BAHOSDDPYZRTJF-UHFFFAOYSA-N
Compound name
3-ethyl-1-[2-(ethylamino)ethyl]-3-phenylindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.18887 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.19615 176.0
[M+Na]+ 331.17809 189.1
[M+NH4]+ 326.22269 185.9
[M+K]+ 347.15203 179.8
[M-H]- 307.18159 180.7
[M+Na-2H]- 329.16354 184.3
[M]+ 308.18832 179.4
[M]- 308.18942 179.4
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.