CID 37648

37126-57-1

Structural Information

Molecular Formula
C24H30N2O
SMILES
CCC1(C2=CC=CC=C2N(C1=O)CCCN3CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C24H30N2O/c1-2-24(20-12-5-3-6-13-20)21-14-7-8-15-22(21)26(23(24)27)19-11-18-25-16-9-4-10-17-25/h3,5-8,12-15H,2,4,9-11,16-19H2,1H3
InChIKey
RIZHDWSPEYRXGX-UHFFFAOYSA-N
Compound name
3-ethyl-3-phenyl-1-(3-piperidin-1-ylpropyl)indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.2358 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.243076 192.7
[M+Na]+ 385.225018 197.4
[M-H]- 361.228524 199.1
[M+NH4]+ 380.269623 206.6
[M+K]+ 401.198958 190.5
[M+H-H2O]+ 345.233060 181.3
[M+HCOO]- 407.234001 207.4
[M+CH3COO]- 421.249651 200.9
[M+Na-2H]- 383.210466 192.2
[M]+ 362.23525142 189.2
[M]- 362.23634858 189.2
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.