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]+ 291.20671 173.2
[M+Na]+ 313.18865 177.5
[M-H]- 289.19215 178.2
[M+NH4]+ 308.23325 185.9
[M+K]+ 329.16259 175.2
[M+H-H2O]+ 273.19669 164.3
[M+HCOO]- 335.19763 190.6
[M+CH3COO]- 349.21328 206.6
[M+Na-2H]- 311.17410 174.4
[M]+ 290.19888 172.1
[M]- 290.19998 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.