| SpectraBase Spectrum ID |
E6Q6cssknj3 |
| Name |
Benzarone-M (di-HO-) 3AC |
| Classification |
Capillary protectant |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
424.115817596 u |
| Formula |
C23H20O8 |
| InChI |
InChI=1S/C23H20O8/c1-5-19-21(22(27)15-6-8-16(9-7-15)28-12(2)24)18-10-17(29-13(3)25)11-20(23(18)31-19)30-14(4)26/h6-11H,5H2,1-4H3 |
| InChIKey |
PPPLCKHVUKVQTN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
424.405 g/mol |
| SMILES |
c1(C(c2c(CC)oc3c(OC(=O)C)cc(cc23)OC(C)=O)=O)ccc(cc1)OC(C)=O |
| SPLASH |
splash10-014i-2590100000-2825d24c9c4878d02e4d |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_2644 |
