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

1
Patents

256.15756 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.164836 160.7
[M+Na]+ 279.146778 167.6
[M-H]- 255.150284 165.1
[M+NH4]+ 274.191383 177.6
[M+K]+ 295.120718 163.1
[M+H-H2O]+ 239.154820 151.8
[M+HCOO]- 301.155761 178.8
[M+CH3COO]- 315.171411 171.8
[M+Na-2H]- 277.132226 163.1
[M]+ 256.15701142 158.9
[M]- 256.15810858 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