CID 3074831

Piperidine, 1-((2-methyl-1h-indol-1-yl)acetyl)-

Structural Information

Molecular Formula
C16H20N2O
SMILES
CC1=CC2=CC=CC=C2N1CC(=O)N3CCCCC3
InChI
InChI=1S/C16H20N2O/c1-13-11-14-7-3-4-8-15(14)18(13)12-16(19)17-9-5-2-6-10-17/h3-4,7-8,11H,2,5-6,9-10,12H2,1H3
InChIKey
TVFAVFDTZUNPDK-UHFFFAOYSA-N
Compound name
2-(2-methylindol-1-yl)-1-piperidin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

256.15756 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 160.7
[M+Na]+ 279.14678 167.6
[M-H]- 255.15028 165.1
[M+NH4]+ 274.19138 177.6
[M+K]+ 295.12072 163.1
[M+H-H2O]+ 239.15482 151.8
[M+HCOO]- 301.15576 178.8
[M+CH3COO]- 315.17141 171.8
[M+Na-2H]- 277.13223 163.1
[M]+ 256.15701 158.9
[M]- 256.15811 158.9
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

patents stripe