CID 14123355

Oxirane, 2,2'-[cyclohexylidenebis(4,1-phenyleneoxymethylene)]bis-

Structural Information

Molecular Formula
C24H28O4
SMILES
C1CCC(CC1)(C2=CC=C(C=C2)OCC3CO3)C4=CC=C(C=C4)OCC5CO5
InChI
InChI=1S/C24H28O4/c1-2-12-24(13-3-1,18-4-8-20(9-5-18)25-14-22-16-27-22)19-6-10-21(11-7-19)26-15-23-17-28-23/h4-11,22-23H,1-3,12-17H2
InChIKey
VDPPRCNXURRGQC-UHFFFAOYSA-N
Compound name
2-[[4-[1-[4-(oxiran-2-ylmethoxy)phenyl]cyclohexyl]phenoxy]methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

87
Patents

380.19876 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.20604 186.8
[M+Na]+ 403.18798 190.8
[M-H]- 379.19148 200.7
[M+NH4]+ 398.23258 187.1
[M+K]+ 419.16192 193.7
[M+H-H2O]+ 363.19602 178.6
[M+HCOO]- 425.19696 201.6
[M+CH3COO]- 439.21261 194.2
[M+Na-2H]- 401.17343 189.0
[M]+ 380.19821 191.2
[M]- 380.19931 191.2
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