CID 58965

2-(5-methoxyskatyl)piperidine hydrochloride

Structural Information

Molecular Formula
C15H20N2O
SMILES
COC1=CC2=C(C=C1)NC=C2CC3CCCCN3
InChI
InChI=1S/C15H20N2O/c1-18-13-5-6-15-14(9-13)11(10-17-15)8-12-4-2-3-7-16-12/h5-6,9-10,12,16-17H,2-4,7-8H2,1H3
InChIKey
NJLYELMBAZHTTA-UHFFFAOYSA-N
Compound name
5-methoxy-3-(piperidin-2-ylmethyl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.15756 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.16484 156.8
[M+Na]+ 267.14678 163.2
[M-H]- 243.15028 158.5
[M+NH4]+ 262.19138 172.8
[M+K]+ 283.12072 157.3
[M+H-H2O]+ 227.15482 148.6
[M+HCOO]- 289.15576 173.1
[M+CH3COO]- 303.17141 167.1
[M+Na-2H]- 265.13223 160.2
[M]+ 244.15701 152.5
[M]- 244.15811 152.5
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.