CID 213924

27291-91-4

Structural Information

Molecular Formula
C21H26N2O
SMILES
CC1=CC=CC=C1N(CC2=CC=CC=C2)C(=O)CN3CCCCC3
InChI
InChI=1S/C21H26N2O/c1-18-10-6-7-13-20(18)23(16-19-11-4-2-5-12-19)21(24)17-22-14-8-3-9-15-22/h2,4-7,10-13H,3,8-9,14-17H2,1H3
InChIKey
PFHRKAWVMBJYQV-UHFFFAOYSA-N
Compound name
N-benzyl-N-(2-methylphenyl)-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.2045 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.211776 179.6
[M+Na]+ 345.193718 181.4
[M-H]- 321.197224 187.3
[M+NH4]+ 340.238323 191.5
[M+K]+ 361.167658 177.4
[M+H-H2O]+ 305.201760 168.6
[M+HCOO]- 367.202701 198.1
[M+CH3COO]- 381.218351 213.3
[M+Na-2H]- 343.179166 181.2
[M]+ 322.20395142 175.4
[M]- 322.20504858 175.4
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.