CID 8523

Phenampromide

Structural Information

Molecular Formula
C17H26N2O
SMILES
CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCCCC2
InChI
InChI=1S/C17H26N2O/c1-3-17(20)19(16-10-6-4-7-11-16)15(2)14-18-12-8-5-9-13-18/h4,6-7,10-11,15H,3,5,8-9,12-14H2,1-2H3
InChIKey
DHTRHEVNFFZCNU-UHFFFAOYSA-N
Compound name
N-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

849
Patents

274.2045 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.211776 168.7
[M+Na]+ 297.193718 169.8
[M-H]- 273.197224 173.3
[M+NH4]+ 292.238323 182.8
[M+K]+ 313.167658 167.9
[M+H-H2O]+ 257.201760 159.3
[M+HCOO]- 319.202701 186.3
[M+CH3COO]- 333.218351 205.2
[M+Na-2H]- 295.179166 169.4
[M]+ 274.20395142 164.9
[M]- 274.20504858 164.9
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