CID 53754

C 2085

Structural Information

Molecular Formula
C18H28N2O3
SMILES
CC1=CC(=C(C(=C1)C)OCCN(C)C(=O)CN2CCOCC2)C
InChI
InChI=1S/C18H28N2O3/c1-14-11-15(2)18(16(3)12-14)23-10-5-19(4)17(21)13-20-6-8-22-9-7-20/h11-12H,5-10,13H2,1-4H3
InChIKey
XMMPQQMNFVBPKV-UHFFFAOYSA-N
Compound name
N-methyl-2-morpholin-4-yl-N-[2-(2,4,6-trimethylphenoxy)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.21 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.217276 180.2
[M+Na]+ 343.199218 184.1
[M-H]- 319.202724 186.5
[M+NH4]+ 338.243823 192.2
[M+K]+ 359.173158 183.6
[M+H-H2O]+ 303.207260 170.8
[M+HCOO]- 365.208201 198.0
[M+CH3COO]- 379.223851 215.2
[M+Na-2H]- 341.184666 180.3
[M]+ 320.20945142 182.1
[M]- 320.21054858 182.1
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.