CID 2761123

394653-85-1

Structural Information

Molecular Formula
C23H29N3O
SMILES
CC(=O)N1CCC2=C1C=CC(=C2)NC3CCN(CC3)CCC4=CC=CC=C4
InChI
InChI=1S/C23H29N3O/c1-18(27)26-16-10-20-17-22(7-8-23(20)26)24-21-11-14-25(15-12-21)13-9-19-5-3-2-4-6-19/h2-8,17,21,24H,9-16H2,1H3
InChIKey
JVFSVNCIJRXULX-UHFFFAOYSA-N
Compound name
1-[5-[[1-(2-phenylethyl)piperidin-4-yl]amino]-2,3-dihydroindol-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.23105 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.23833 192.0
[M+Na]+ 386.22027 203.9
[M+NH4]+ 381.26487 200.0
[M+K]+ 402.19421 197.0
[M-H]- 362.22377 197.9
[M+Na-2H]- 384.20572 198.6
[M]+ 363.23050 195.2
[M]- 363.23160 195.2
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.