CID 779146

4-morpholinebutanamide, n-(2,4,6-trimethylphenyl)-, monohydrochloride

Structural Information

Molecular Formula
C17H26N2O2
SMILES
CC1=CC(=C(C(=C1)C)NC(=O)CCCN2CCOCC2)C
InChI
InChI=1S/C17H26N2O2/c1-13-11-14(2)17(15(3)12-13)18-16(20)5-4-6-19-7-9-21-10-8-19/h11-12H,4-10H2,1-3H3,(H,18,20)
InChIKey
MYMPGJXTYMQSIF-UHFFFAOYSA-N
Compound name
4-morpholin-4-yl-N-(2,4,6-trimethylphenyl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

290.19943 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.206706 173.2
[M+Na]+ 313.188648 177.5
[M-H]- 289.192154 178.2
[M+NH4]+ 308.233253 185.9
[M+K]+ 329.162588 175.2
[M+H-H2O]+ 273.196690 164.3
[M+HCOO]- 335.197631 190.6
[M+CH3COO]- 349.213281 206.6
[M+Na-2H]- 311.174096 174.4
[M]+ 290.19888142 172.1
[M]- 290.19997858 172.1
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

No patent data available for this compound.