CID 39296

1,3-dihydro-3-phenyl-1-(3-piperidinopropyl)-2h-indol-2-one hydrochloride

Structural Information

Molecular Formula
C22H26N2O
SMILES
C1CCN(CC1)CCCN2C3=CC=CC=C3C(C2=O)C4=CC=CC=C4
InChI
InChI=1S/C22H26N2O/c25-22-21(18-10-3-1-4-11-18)19-12-5-6-13-20(19)24(22)17-9-16-23-14-7-2-8-15-23/h1,3-6,10-13,21H,2,7-9,14-17H2
InChIKey
WRDBJGIVCBTWMM-UHFFFAOYSA-N
Compound name
3-phenyl-1-(3-piperidin-1-ylpropyl)-3H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.2045 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.211776 183.5
[M+Na]+ 357.193718 187.9
[M-H]- 333.197224 189.8
[M+NH4]+ 352.238323 196.4
[M+K]+ 373.167658 181.2
[M+H-H2O]+ 317.201760 172.4
[M+HCOO]- 379.202701 198.8
[M+CH3COO]- 393.218351 192.1
[M+Na-2H]- 355.179166 183.1
[M]+ 334.20395142 179.0
[M]- 334.20504858 179.0
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.