CID 11015594

64363-77-5

Structural Information

Molecular Formula
C27H30O5
SMILES
COC1[C@@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4
InChI
InChI=1S/C27H30O5/c1-28-27-26(31-19-23-15-9-4-10-16-23)25(30-18-22-13-7-3-8-14-22)24(32-27)20-29-17-21-11-5-2-6-12-21/h2-16,24-27H,17-20H2,1H3/t24-,25-,26-,27?/m1/s1
InChIKey
DJVKHGGGJZLGII-YGENNMJRSA-N
Compound name
(3R,4R,5R)-2-methoxy-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

434.20932 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.21660 208.6
[M+Na]+ 457.19854 222.9
[M+NH4]+ 452.24314 215.9
[M+K]+ 473.17248 215.4
[M-H]- 433.20204 217.6
[M+Na-2H]- 455.18399 217.7
[M]+ 434.20877 213.3
[M]- 434.20987 213.3
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