CID 58963

3-indolemethanol, alpha-(4-piperidyl)-

Structural Information

Molecular Formula
C14H18N2O
SMILES
C1CNCCC1C(C2=CNC3=CC=CC=C32)O
InChI
InChI=1S/C14H18N2O/c17-14(10-5-7-15-8-6-10)12-9-16-13-4-2-1-3-11(12)13/h1-4,9-10,14-17H,5-8H2
InChIKey
SMNYYJOJHZYPGO-UHFFFAOYSA-N
Compound name
1H-indol-3-yl(piperidin-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.149176 152.3
[M+Na]+ 253.131118 157.5
[M-H]- 229.134624 152.6
[M+NH4]+ 248.175723 167.8
[M+K]+ 269.105058 151.5
[M+H-H2O]+ 213.139160 144.5
[M+HCOO]- 275.140101 166.5
[M+CH3COO]- 289.155751 161.9
[M+Na-2H]- 251.116566 155.5
[M]+ 230.14135142 144.9
[M]- 230.14244858 144.9
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

No patent data available for this compound.