![8,9,10,11,12,13,23,24,25,26,27,28-Dodecahydro-6H,21H-dibenzo[b,o][1,4,14,17]tetraoxacyclohexacosine-6,14,21,29(7H,22H)-tetrone](/api/spectrum/KAHNul2af5Q/structure.png?h=300&w=458 "8,9,10,11,12,13,23,24,25,26,27,28-Dodecahydro-6H,21H-dibenzo[b,o][1,4,14,17]tetraoxacyclohexacosine-6,14,21,29(7H,22H)-tetrone")
| SpectraBase Compound ID | Ly9Cjy2IYL3 |
|---|---|
| InChI | InChI=1S/C30H36O8/c31-27-19-7-3-1-4-8-20-28(32)36-24-16-12-14-18-26(24)38-30(34)22-10-6-2-5-9-21-29(33)37-25-17-13-11-15-23(25)35-27/h11-18H,1-10,19-22H2 |
| InChIKey | FRNFQMBCLASCHV-UHFFFAOYSA-N |
| Mol Weight | 524.6 g/mol |
| Molecular Formula | C30H36O8 |
| Exact Mass | 524.241018 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KAHNul2af5Q |
|---|---|
| Name | 8,9,10,11,12,13,23,24,25,26,27,28-Dodecahydro-6H,21H-dibenzo[b,o][1,4,14,17]tetraoxacyclohexacosine-6,14,21,29(7H,22H)-tetrone |
| Alternate Name(s) | Cyclic ester of bis-benzene-1,2-diol bis-nonanedioate |
| CAS Registry Number | 85933-08-0 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H36O8 |
| InChI | InChI=1S/C30H36O8/c31-27-19-7-3-1-4-8-20-28(32)36-24-16-12-14-18-26(24)38-30(34)22-10-6-2-5-9-21-29(33)37-25-17-13-11-15-23(25)35-27/h11-18H,1-10,19-22H2 |
| InChIKey | FRNFQMBCLASCHV-UHFFFAOYSA-N |
| Molecular Weight | 524.610 g/mol |
| SMILES | c1ccc2c(c1)OC(CCCCCCCC(=O)Oc1ccccc1OC(CCCCCCCC(=O)O2)=O)=O |
| SPLASH | splash10-0a4i-9000000000-d5f520b717895e03494a |
| Source of Spectrum | Y-20-1398-0 |
| Wiley ID | 1402590 |