CID 62247

68239-42-9

Structural Information

Molecular Formula
C15H30O10
SMILES
CO[C@H]1C(C(C([C@H](O1)COCCO)OCCO)OCCO)OCCO
InChI
InChI=1S/C15H30O10/c1-20-15-14(24-9-5-19)13(23-8-4-18)12(22-7-3-17)11(25-15)10-21-6-2-16/h11-19H,2-10H2,1H3/t11-,12?,13?,14?,15-/m1/s1
InChIKey
UITSPQLTFPTHJZ-XTLGRWLVSA-N
Compound name
2-[[(2R,6R)-3,4,5-tris(2-hydroxyethoxy)-6-methoxyoxan-2-yl]methoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

412
Patents

370.1839 Da
Monoisotopic Mass

-3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.19118 180.6
[M+Na]+ 393.17312 182.8
[M-H]- 369.17662 178.0
[M+NH4]+ 388.21772 188.8
[M+K]+ 409.14706 183.8
[M+H-H2O]+ 353.18116 173.2
[M+HCOO]- 415.18210 193.7
[M+CH3COO]- 429.19775 207.6
[M+Na-2H]- 391.15857 180.5
[M]+ 370.18335 187.8
[M]- 370.18445 187.8
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