CID 690446

64544-17-8

Structural Information

Molecular Formula
C17H26N2O2
SMILES
CC(C)(C)C1=CC=C(C=C1)C(=O)NCCN2CCOCC2
InChI
InChI=1S/C17H26N2O2/c1-17(2,3)15-6-4-14(5-7-15)16(20)18-8-9-19-10-12-21-13-11-19/h4-7H,8-13H2,1-3H3,(H,18,20)
InChIKey
INFBBMJKSJJOQW-UHFFFAOYSA-N
Compound name
4-tert-butyl-N-(2-morpholin-4-ylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

23
Patents

290.19943 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.206706 172.4
[M+Na]+ 313.188648 175.3
[M-H]- 289.192154 177.0
[M+NH4]+ 308.233253 184.6
[M+K]+ 329.162588 173.6
[M+H-H2O]+ 273.196690 163.8
[M+HCOO]- 335.197631 188.3
[M+CH3COO]- 349.213281 204.0
[M+Na-2H]- 311.174096 176.0
[M]+ 290.19888142 170.0
[M]- 290.19997858 170.0
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

patents stripe