CID 425243

51491-49-7

Structural Information

Molecular Formula
C17H26N2O
SMILES
CC(C)(C)NC(=O)C1CC(CN(C1)C)C2=CC=CC=C2
InChI
InChI=1S/C17H26N2O/c1-17(2,3)18-16(20)15-10-14(11-19(4)12-15)13-8-6-5-7-9-13/h5-9,14-15H,10-12H2,1-4H3,(H,18,20)
InChIKey
FLUDYZAZMCKRQE-UHFFFAOYSA-N
Compound name
N-tert-butyl-1-methyl-5-phenylpiperidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.2045 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.211776 168.3
[M+Na]+ 297.193718 172.1
[M-H]- 273.197224 172.7
[M+NH4]+ 292.238323 182.9
[M+K]+ 313.167658 168.9
[M+H-H2O]+ 257.201760 160.3
[M+HCOO]- 319.202701 184.9
[M+CH3COO]- 333.218351 203.0
[M+Na-2H]- 295.179166 170.4
[M]+ 274.20395142 164.3
[M]- 274.20504858 164.3
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.