CID 3062644

Piperidine, 1-(2-(thymyloxy)ethyl)-

Structural Information

Molecular Formula
C17H27NO
SMILES
CC1=CC(=C(C=C1)C(C)C)OCCN2CCCCC2
InChI
InChI=1S/C17H27NO/c1-14(2)16-8-7-15(3)13-17(16)19-12-11-18-9-5-4-6-10-18/h7-8,13-14H,4-6,9-12H2,1-3H3
InChIKey
NZOGYYPRSKRSQM-UHFFFAOYSA-N
Compound name
1-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.20926 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.21654 165.7
[M+Na]+ 284.19848 169.4
[M-H]- 260.20198 169.6
[M+NH4]+ 279.24308 180.9
[M+K]+ 300.17242 166.3
[M+H-H2O]+ 244.20652 157.1
[M+HCOO]- 306.20746 182.6
[M+CH3COO]- 320.22311 199.8
[M+Na-2H]- 282.18393 166.4
[M]+ 261.20871 163.5
[M]- 261.20981 163.5
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.