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 174.9
[M+Na]+ 331.17809 182.4
[M-H]- 307.18159 181.1
[M+NH4]+ 326.22269 193.1
[M+K]+ 347.15203 176.6
[M+H-H2O]+ 291.18613 166.5
[M+HCOO]- 353.18707 196.6
[M+CH3COO]- 367.20272 209.4
[M+Na-2H]- 329.16354 178.6
[M]+ 308.18832 176.2
[M]- 308.18942 176.2
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.