CID 3074829

163629-07-0

Structural Information

Molecular Formula
C17H22N2O
SMILES
CC1=CC2=CC=CC=C2N1CC(=O)NC3CCCCC3
InChI
InChI=1S/C17H22N2O/c1-13-11-14-7-5-6-10-16(14)19(13)12-17(20)18-15-8-3-2-4-9-15/h5-7,10-11,15H,2-4,8-9,12H2,1H3,(H,18,20)
InChIKey
UKDZROYUHRFZMK-UHFFFAOYSA-N
Compound name
N-cyclohexyl-2-(2-methylindol-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

270.17322 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.180496 163.8
[M+Na]+ 293.162438 169.3
[M-H]- 269.165944 169.4
[M+NH4]+ 288.207043 181.1
[M+K]+ 309.136378 164.7
[M+H-H2O]+ 253.170480 155.4
[M+HCOO]- 315.171421 184.0
[M+CH3COO]- 329.187071 174.7
[M+Na-2H]- 291.147886 166.4
[M]+ 270.17267142 161.2
[M]- 270.17376858 161.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.