CID 120779

738-53-4

Structural Information

Molecular Formula
C16H23FN2O2
SMILES
CCC1=CC(=C(C=C1)F)NC(=O)CC(C)N2CCOCC2
InChI
InChI=1S/C16H23FN2O2/c1-3-13-4-5-14(17)15(11-13)18-16(20)10-12(2)19-6-8-21-9-7-19/h4-5,11-12H,3,6-10H2,1-2H3,(H,18,20)
InChIKey
KNNLXBYTOJJCPH-UHFFFAOYSA-N
Compound name
N-(5-ethyl-2-fluorophenyl)-3-morpholin-4-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.17435 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.18163 171.9
[M+Na]+ 317.16357 175.4
[M-H]- 293.16707 175.3
[M+NH4]+ 312.20817 183.8
[M+K]+ 333.13751 173.4
[M+H-H2O]+ 277.17161 162.0
[M+HCOO]- 339.17255 187.5
[M+CH3COO]- 353.18820 206.0
[M+Na-2H]- 315.14902 172.5
[M]+ 294.17380 168.3
[M]- 294.17490 168.3
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.