CID 38279

N-(2-methyl-4-phenoxyphenyl)-2-(propylamino)acetamide hydrochloride

Structural Information

Molecular Formula
C18H22N2O2
SMILES
CCCNCC(=O)NC1=C(C=C(C=C1)OC2=CC=CC=C2)C
InChI
InChI=1S/C18H22N2O2/c1-3-11-19-13-18(21)20-17-10-9-16(12-14(17)2)22-15-7-5-4-6-8-15/h4-10,12,19H,3,11,13H2,1-2H3,(H,20,21)
InChIKey
JFURMEYGLGQHQE-UHFFFAOYSA-N
Compound name
N-(2-methyl-4-phenoxyphenyl)-2-(propylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.16812 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.17540 171.6
[M+Na]+ 321.15734 176.4
[M-H]- 297.16084 177.8
[M+NH4]+ 316.20194 186.0
[M+K]+ 337.13128 172.6
[M+H-H2O]+ 281.16538 162.8
[M+HCOO]- 343.16632 196.2
[M+CH3COO]- 357.18197 209.7
[M+Na-2H]- 319.14279 175.6
[M]+ 298.16757 172.8
[M]- 298.16867 172.8
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.