CID 4172562

2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidine

Structural Information

Molecular Formula
C17H27NO
SMILES
CC(C1=CC=CC=C1)ON2C(CCCC2(C)C)(C)C
InChI
InChI=1S/C17H27NO/c1-14(15-10-7-6-8-11-15)19-18-16(2,3)12-9-13-17(18,4)5/h6-8,10-11,14H,9,12-13H2,1-5H3
InChIKey
WURBRXPDUPECQX-UHFFFAOYSA-N
Compound name
2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

300
Patents

261.20926 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.21654 163.1
[M+Na]+ 284.19848 169.0
[M-H]- 260.20198 168.0
[M+NH4]+ 279.24308 182.6
[M+K]+ 300.17242 166.7
[M+H-H2O]+ 244.20652 155.9
[M+HCOO]- 306.20746 180.2
[M+CH3COO]- 320.22311 199.0
[M+Na-2H]- 282.18393 166.3
[M]+ 261.20871 161.8
[M]- 261.20981 161.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe