CID 3041917

58774-96-2

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]+ 232.16959 154.2
[M+Na]+ 254.15153 160.6
[M-H]- 230.15503 160.4
[M+NH4]+ 249.19613 174.2
[M+K]+ 270.12547 158.2
[M+H-H2O]+ 214.15957 146.9
[M+HCOO]- 276.16051 171.1
[M+CH3COO]- 290.17616 166.1
[M+Na-2H]- 252.13698 158.1
[M]+ 231.16176 150.9
[M]- 231.16286 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.