CID 43098

Indoline, 2-methyl-1-(2-methylpiperidinoacetyl)-, 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]+ 273.196146 168.0
[M+Na]+ 295.178088 173.2
[M-H]- 271.181594 171.8
[M+NH4]+ 290.222693 184.2
[M+K]+ 311.152028 168.9
[M+H-H2O]+ 255.186130 159.2
[M+HCOO]- 317.187071 182.8
[M+CH3COO]- 331.202721 200.0
[M+Na-2H]- 293.163536 167.1
[M]+ 272.18832142 164.0
[M]- 272.18941858 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.