CID 53756

77791-42-5

Structural Information

Molecular Formula
C17H26N2O2
SMILES
CC1CCCCN1CC(=O)N(C)CCOC2=CC=CC=C2
InChI
InChI=1S/C17H26N2O2/c1-15-8-6-7-11-19(15)14-17(20)18(2)12-13-21-16-9-4-3-5-10-16/h3-5,9-10,15H,6-8,11-14H2,1-2H3
InChIKey
KHPSQLYDXDUDQU-UHFFFAOYSA-N
Compound name
N-methyl-2-(2-methylpiperidin-1-yl)-N-(2-phenoxyethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.19943 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.20671 171.5
[M+Na]+ 313.18865 173.8
[M-H]- 289.19215 176.5
[M+NH4]+ 308.23325 185.3
[M+K]+ 329.16259 172.0
[M+H-H2O]+ 273.19669 162.0
[M+HCOO]- 335.19763 190.4
[M+CH3COO]- 349.21328 207.5
[M+Na-2H]- 311.17410 172.8
[M]+ 290.19888 170.2
[M]- 290.19998 170.2
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.