CID 43098

2-methyl-1-(2-methylpiperidinoacetyl)indoline hydrochloride

Structural Information

Molecular Formula
C17H24N2O
SMILES
CC1CCCCN1CC(=O)N2C(CC3=CC=CC=C32)C
InChI
InChI=1S/C17H24N2O/c1-13-7-5-6-10-18(13)12-17(20)19-14(2)11-15-8-3-4-9-16(15)19/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3
InChIKey
RZZZUWOUKYUYQM-UHFFFAOYSA-N
Compound name
1-(2-methyl-2,3-dihydroindol-1-yl)-2-(2-methylpiperidin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.18887 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.19615 168.0
[M+Na]+ 295.17809 173.2
[M-H]- 271.18159 171.8
[M+NH4]+ 290.22269 184.2
[M+K]+ 311.15203 168.9
[M+H-H2O]+ 255.18613 159.2
[M+HCOO]- 317.18707 182.8
[M+CH3COO]- 331.20272 200.0
[M+Na-2H]- 293.16354 167.1
[M]+ 272.18832 164.0
[M]- 272.18942 164.0
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.