CID 66968

2-methoxyethyl myristate

Structural Information

Molecular Formula
C17H34O3
SMILES
CCCCCCCCCCCCCC(=O)OCCOC
InChI
InChI=1S/C17H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-17(18)20-16-15-19-2/h3-16H2,1-2H3
InChIKey
KVFSSOAOLLIISP-UHFFFAOYSA-N
Compound name
2-methoxyethyl tetradecanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

286.2508 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.258076 177.5
[M+Na]+ 309.240018 180.2
[M-H]- 285.243524 175.8
[M+NH4]+ 304.284623 193.4
[M+K]+ 325.213958 178.4
[M+H-H2O]+ 269.248060 170.7
[M+HCOO]- 331.249001 197.6
[M+CH3COO]- 345.264651 205.4
[M+Na-2H]- 307.225466 177.4
[M]+ 286.25025142 185.9
[M]- 286.25134858 185.9
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