CID 316522

4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane

Structural Information

Molecular Formula
C15H26O6
SMILES
CC1(OCC(O1)C2C(OC(O2)(C)C)C3COC(O3)(C)C)C
InChI
InChI=1S/C15H26O6/c1-13(2)16-7-9(18-13)11-12(21-15(5,6)20-11)10-8-17-14(3,4)19-10/h9-12H,7-8H2,1-6H3
InChIKey
CKECEWYVEGPMPE-UHFFFAOYSA-N
Compound name
4,5-bis(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

302.17294 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.180216 159.6
[M+Na]+ 325.162158 167.2
[M-H]- 301.165664 172.7
[M+NH4]+ 320.206763 177.6
[M+K]+ 341.136098 172.6
[M+H-H2O]+ 285.170200 161.6
[M+HCOO]- 347.171141 173.7
[M+CH3COO]- 361.186791 202.9
[M+Na-2H]- 323.147606 163.7
[M]+ 302.17239142 165.6
[M]- 302.17348858 165.6
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