CID 24704823

4-(2,6-dimethylphenoxy)piperidine

Structural Information

Molecular Formula
C13H19NO
SMILES
CC1=C(C(=CC=C1)C)OC2CCNCC2
InChI
InChI=1S/C13H19NO/c1-10-4-3-5-11(2)13(10)15-12-6-8-14-9-7-12/h3-5,12,14H,6-9H2,1-2H3
InChIKey
GIMDUKQMEPRHGE-UHFFFAOYSA-N
Compound name
4-(2,6-dimethylphenoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 147.9
[M+Na]+ 228.13589 153.3
[M-H]- 204.13939 151.2
[M+NH4]+ 223.18049 164.9
[M+K]+ 244.10983 149.8
[M+H-H2O]+ 188.14393 140.4
[M+HCOO]- 250.14487 165.8
[M+CH3COO]- 264.16052 184.3
[M+Na-2H]- 226.12134 151.7
[M]+ 205.14612 143.2
[M]- 205.14722 143.2
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.