CID 41163

Indole, 3-methyl-2-(piperidinyl)-

Structural Information

Molecular Formula
C14H18N2
SMILES
CC1=C(NC2=CC=CC=C12)N3CCCCC3
InChI
InChI=1S/C14H18N2/c1-11-12-7-3-4-8-13(12)15-14(11)16-9-5-2-6-10-16/h3-4,7-8,15H,2,5-6,9-10H2,1H3
InChIKey
ISVAOKODISJOPR-UHFFFAOYSA-N
Compound name
3-methyl-2-piperidin-1-yl-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

214.147 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.15428 149.0
[M+Na]+ 237.13622 156.5
[M-H]- 213.13972 152.3
[M+NH4]+ 232.18082 167.1
[M+K]+ 253.11016 151.1
[M+H-H2O]+ 197.14426 140.8
[M+HCOO]- 259.14520 167.0
[M+CH3COO]- 273.16085 160.6
[M+Na-2H]- 235.12167 153.3
[M]+ 214.14645 144.7
[M]- 214.14755 144.7
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

patents stripe