CID 3041917

Piperidine, 1-(2,3-dihydro-2,2-dimethyl-3-benzofuranyl)-

Structural Information

Molecular Formula
C15H21NO
SMILES
CC1(C(C2=CC=CC=C2O1)N3CCCCC3)C
InChI
InChI=1S/C15H21NO/c1-15(2)14(16-10-6-3-7-11-16)12-8-4-5-9-13(12)17-15/h4-5,8-9,14H,3,6-7,10-11H2,1-2H3
InChIKey
CSXZTYLMUJFOMB-UHFFFAOYSA-N
Compound name
1-(2,2-dimethyl-3H-1-benzofuran-3-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.16231 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.169586 154.2
[M+Na]+ 254.151528 160.6
[M-H]- 230.155034 160.4
[M+NH4]+ 249.196133 174.2
[M+K]+ 270.125468 158.2
[M+H-H2O]+ 214.159570 146.9
[M+HCOO]- 276.160511 171.1
[M+CH3COO]- 290.176161 166.1
[M+Na-2H]- 252.136976 158.1
[M]+ 231.16176142 150.9
[M]- 231.16285858 150.9
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.