CID 9866479
2,6-bis(4-ethylphenyl)perhydro-1,3,5,7-tetraoxanaphth-4-ylethane-1,2-diol
Structural Information
- Molecular Formula
- C24H30O6
- SMILES
- CCC1=CC=C(C=C1)C2OCC3C(O2)C(OC(O3)C4=CC=C(C=C4)CC)C(CO)O
- InChI
- InChI=1S/C24H30O6/c1-3-15-5-9-17(10-6-15)23-27-14-20-22(30-23)21(19(26)13-25)29-24(28-20)18-11-7-16(4-2)8-12-18/h5-12,19-26H,3-4,13-14H2,1-2H3
- InChIKey
- RPMMDFYGVMKCJU-UHFFFAOYSA-N
- Compound name
- 1-[2,6-bis(4-ethylphenyl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl]ethane-1,2-diol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 415.21150 | 205.5 |
[M+Na]+ | 437.19344 | 208.7 |
[M-H]- | 413.19694 | 214.7 |
[M+NH4]+ | 432.23804 | 209.5 |
[M+K]+ | 453.16738 | 209.3 |
[M+H-H2O]+ | 397.20148 | 195.8 |
[M+HCOO]- | 459.20242 | 213.4 |
[M+CH3COO]- | 473.21807 | 212.6 |
[M+Na-2H]- | 435.17889 | 205.5 |
[M]+ | 414.20367 | 205.8 |
[M]- | 414.20477 | 205.8 |
Literature stripe
No literature data available for this compound.