CID 174103

(2-methoxyethoxy)cyclododecane

Structural Information

Molecular Formula
C15H30O2
SMILES
COCCOC1CCCCCCCCCCC1
InChI
InChI=1S/C15H30O2/c1-16-13-14-17-15-11-9-7-5-3-2-4-6-8-10-12-15/h15H,2-14H2,1H3
InChIKey
ZVBSFYUMDOTFAC-UHFFFAOYSA-N
Compound name
2-methoxyethoxycyclododecane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

21
Patents

242.22458 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.231856 159.9
[M+Na]+ 265.213798 160.4
[M-H]- 241.217304 159.1
[M+NH4]+ 260.258403 174.0
[M+K]+ 281.187738 160.1
[M+H-H2O]+ 225.221840 156.2
[M+HCOO]- 287.222781 175.8
[M+CH3COO]- 301.238431 186.8
[M+Na-2H]- 263.199246 160.4
[M]+ 242.22403142 152.2
[M]- 242.22512858 152.2
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