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Ethylene glycol ketal of cis-3-acetyl-6-(o-hydroxybenzoyl)-1,5,8-trihydroxytetralin 1,8-acetamide
SpectraBase Compound ID 1wHOlOB2DBY
InChI InChI=1S/C24H26O7/c1-23(2)30-18-11-13(24(3)28-8-9-29-24)10-15-20(18)19(31-23)12-16(22(15)27)21(26)14-6-4-5-7-17(14)25/h4-7,12-13,18,25,27H,8-11H2,1-3H3/t13-,18-/m0/s1
InChIKey WQLNKDCTPRAYLE-UGSOOPFHSA-N
Mol Weight 426.47 g/mol
Molecular Formula C24H26O7
Exact Mass 426.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jzPrw7VANa
Name Ethylene glycol ketal of cis-3-acetyl-6-(o-hydroxybenzoyl)-1,5,8-trihydroxytetralin 1,8-acetamide
CAS Registry Number 90623-87-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26O7
InChI InChI=1S/C24H26O7/c1-23(2)30-18-11-13(24(3)28-8-9-29-24)10-15-20(18)19(31-23)12-16(22(15)27)21(26)14-6-4-5-7-17(14)25/h4-7,12-13,18,25,27H,8-11H2,1-3H3/t13-,18-/m0/s1
InChIKey WQLNKDCTPRAYLE-UGSOOPFHSA-N
Molecular Weight 426.465 g/mol
SMILES Oc1c(C(c2cc3c4[C@](C[C@](Cc4c2O)(C2(OCCO2)C)[H])(OC(O3)(C)C)[H])=O)cccc1
SPLASH splash10-000i-9301000000-c2501bdfd33c59ef29e4
Source of Spectrum J-49-2854-0
Synonyms [(8S,9aS)-6-hydroxy-2,2-dimethyl-8-(2-methyl-1,3-dioxolan-2-yl)-7,8,9,9a-tetrahydronaphtho[1,8-de][1,3]dioxin-5-yl](2-hydroxyphenyl)methanone
Wiley ID 1379953