CID 37646

1,3-dihydro-1-(3-(diethylamino)propyl)-3-ethyl-3-phenyl-2h-indol-2-one hydrochloride

Structural Information

Molecular Formula
C23H30N2O
SMILES
CCC1(C2=CC=CC=C2N(C1=O)CCCN(CC)CC)C3=CC=CC=C3
InChI
InChI=1S/C23H30N2O/c1-4-23(19-13-8-7-9-14-19)20-15-10-11-16-21(20)25(22(23)26)18-12-17-24(5-2)6-3/h7-11,13-16H,4-6,12,17-18H2,1-3H3
InChIKey
NNRFSJWVVBHHBG-UHFFFAOYSA-N
Compound name
1-[3-(diethylamino)propyl]-3-ethyl-3-phenylindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2358 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.24308 188.9
[M+Na]+ 373.22502 195.0
[M-H]- 349.22852 195.8
[M+NH4]+ 368.26962 205.8
[M+K]+ 389.19896 189.9
[M+H-H2O]+ 333.23306 179.6
[M+HCOO]- 395.23400 209.9
[M+CH3COO]- 409.24965 221.6
[M+Na-2H]- 371.21047 190.0
[M]+ 350.23525 192.2
[M]- 350.23635 192.2
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.