CID 4124653
2,6-dibenzyloxyhydroquinone diacetate
Structural Information
- Molecular Formula
- C24H22O6
- SMILES
- CC(=O)OC1=CC(=C(C(=C1)OCC2=CC=CC=C2)OC(=O)C)OCC3=CC=CC=C3
- InChI
- InChI=1S/C24H22O6/c1-17(25)29-21-13-22(27-15-19-9-5-3-6-10-19)24(30-18(2)26)23(14-21)28-16-20-11-7-4-8-12-20/h3-14H,15-16H2,1-2H3
- InChIKey
- CSSMRIUJVDNLGI-UHFFFAOYSA-N
- Compound name
- [4-acetyloxy-3,5-bis(phenylmethoxy)phenyl] acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 407.14891 | 196.9 |
[M+Na]+ | 429.13085 | 202.1 |
[M-H]- | 405.13435 | 206.2 |
[M+NH4]+ | 424.17545 | 206.5 |
[M+K]+ | 445.10479 | 199.6 |
[M+H-H2O]+ | 389.13889 | 186.1 |
[M+HCOO]- | 451.13983 | 218.4 |
[M+CH3COO]- | 465.15548 | 222.5 |
[M+Na-2H]- | 427.11630 | 197.6 |
[M]+ | 406.14108 | 203.2 |
[M]- | 406.14218 | 203.2 |
Literature stripe
Patent stripe
No patent data available for this compound.