CID 105299

3-myristoylamidopropyl morpholine oxide

Structural Information

Molecular Formula
C21H42N2O3
SMILES
CCCCCCCCCCCCCC(=O)NCCC[N+]1(CCOCC1)[O-]
InChI
InChI=1S/C21H42N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-21(24)22-15-13-16-23(25)17-19-26-20-18-23/h2-20H2,1H3,(H,22,24)
InChIKey
STYCFTQPURZRQV-UHFFFAOYSA-N
Compound name
N-[3-(4-oxidomorpholin-4-ium-4-yl)propyl]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.31955 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.32683 198.8
[M+Na]+ 393.30877 197.3
[M-H]- 369.31227 196.9
[M+NH4]+ 388.35337 208.8
[M+K]+ 409.28271 189.9
[M+H-H2O]+ 353.31681 195.2
[M+HCOO]- 415.31775 212.5
[M+CH3COO]- 429.33340 211.0
[M+Na-2H]- 391.29422 200.6
[M]+ 370.31900 198.1
[M]- 370.32010 198.1
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.