CID 255457

60933-68-8

Structural Information

Molecular Formula
C26H28O5
SMILES
C1=CC=C(C=C1)COCC2C(C(C(O2)O)OCC3=CC=CC=C3)OCC4=CC=CC=C4
InChI
InChI=1S/C26H28O5/c27-26-25(30-18-22-14-8-3-9-15-22)24(29-17-21-12-6-2-7-13-21)23(31-26)19-28-16-20-10-4-1-5-11-20/h1-15,23-27H,16-19H2
InChIKey
NAQUAXSCBJPECG-UHFFFAOYSA-N
Compound name
3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

259
Patents

420.19366 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.20094 204.7
[M+Na]+ 443.18288 218.6
[M+NH4]+ 438.22748 211.8
[M+K]+ 459.15682 211.7
[M-H]- 419.18638 213.2
[M+Na-2H]- 441.16833 213.5
[M]+ 420.19311 209.2
[M]- 420.19421 209.2
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