CID 86278223

1-(2-methoxyethoxy)dodecan-2-ol

Structural Information

Molecular Formula
C15H32O3
SMILES
CCCCCCCCCCC(COCCOC)O
InChI
InChI=1S/C15H32O3/c1-3-4-5-6-7-8-9-10-11-15(16)14-18-13-12-17-2/h15-16H,3-14H2,1-2H3
InChIKey
PGWGEIJKUDNFRT-UHFFFAOYSA-N
Compound name
1-(2-methoxyethoxy)dodecan-2-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

260.23514 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.24242 170.3
[M+Na]+ 283.22436 173.0
[M-H]- 259.22786 167.4
[M+NH4]+ 278.26896 186.5
[M+K]+ 299.19830 171.4
[M+H-H2O]+ 243.23240 163.9
[M+HCOO]- 305.23334 189.3
[M+CH3COO]- 319.24899 198.3
[M+Na-2H]- 281.20981 170.7
[M]+ 260.23459 176.8
[M]- 260.23569 176.8
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