CID 120382

Brn 1081508

Structural Information

Molecular Formula
C17H26N2O2
SMILES
CCC1=CC(=C(C=C1)C)NC(=O)CCCN2CCOCC2
InChI
InChI=1S/C17H26N2O2/c1-3-15-7-6-14(2)16(13-15)18-17(20)5-4-8-19-9-11-21-12-10-19/h6-7,13H,3-5,8-12H2,1-2H3,(H,18,20)
InChIKey
ZUILUKTXOMAIMV-UHFFFAOYSA-N
Compound name
N-(5-ethyl-2-methylphenyl)-4-morpholin-4-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.19943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.20671 173.0
[M+Na]+ 313.18865 176.3
[M-H]- 289.19215 177.6
[M+NH4]+ 308.23325 185.3
[M+K]+ 329.16259 174.0
[M+H-H2O]+ 273.19669 163.9
[M+HCOO]- 335.19763 190.5
[M+CH3COO]- 349.21328 205.4
[M+Na-2H]- 311.17410 175.0
[M]+ 290.19888 171.5
[M]- 290.19998 171.5
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.