CID 294274

4-tridecanoylmorpholine

Structural Information

Molecular Formula
C17H33NO2
SMILES
CCCCCCCCCCCCC(=O)N1CCOCC1
InChI
InChI=1S/C17H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17(19)18-13-15-20-16-14-18/h2-16H2,1H3
InChIKey
LEHHXQAJLHGVBZ-UHFFFAOYSA-N
Compound name
1-morpholin-4-yltridecan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

283.25113 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.258406 176.4
[M+Na]+ 306.240348 177.3
[M-H]- 282.243854 176.4
[M+NH4]+ 301.284953 189.2
[M+K]+ 322.214288 175.8
[M+H-H2O]+ 266.248390 167.9
[M+HCOO]- 328.249331 191.3
[M+CH3COO]- 342.264981 202.4
[M+Na-2H]- 304.225796 176.9
[M]+ 283.25058142 177.4
[M]- 283.25167858 177.4
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

patents stripe