CID 3054784

1-(2-(2-methyl-1h-indol-3-yl)ethyl)-3-piperidinol

Structural Information

Molecular Formula
C16H22N2O
SMILES
CC1=C(C2=CC=CC=C2N1)CCN3CCCC(C3)O
InChI
InChI=1S/C16H22N2O/c1-12-14(15-6-2-3-7-16(15)17-12)8-10-18-9-4-5-13(19)11-18/h2-3,6-7,13,17,19H,4-5,8-11H2,1H3
InChIKey
QTSGIPLJZBOWNT-UHFFFAOYSA-N
Compound name
1-[2-(2-methyl-1H-indol-3-yl)ethyl]piperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.17322 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.18050 161.8
[M+Na]+ 281.16244 168.8
[M-H]- 257.16594 163.8
[M+NH4]+ 276.20704 177.6
[M+K]+ 297.13638 162.6
[M+H-H2O]+ 241.17048 153.7
[M+HCOO]- 303.17142 177.8
[M+CH3COO]- 317.18707 172.0
[M+Na-2H]- 279.14789 164.0
[M]+ 258.17267 158.2
[M]- 258.17377 158.2
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.