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4a-(tert-Butoxycarbonyl)-2-(4'-methoxyphenyl)-4a,7,8,8a-tetrahydro-4H-benzo[b]pyran-4,7-dione
SpectraBase Compound ID LUpwxUKQA0v
InChI InChI=1S/C21H22O6/c1-20(2,3)27-19(24)21-10-9-14(22)11-18(21)26-16(12-17(21)23)13-5-7-15(25-4)8-6-13/h5-10,12,18H,11H2,1-4H3
InChIKey JFAHDECMGBAGCI-UHFFFAOYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Iwe6UB00tO
Name 4a-(tert-Butoxycarbonyl)-2-(4'-methoxyphenyl)-4a,7,8,8a-tetrahydro-4H-benzo[b]pyran-4,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-20(2,3)27-19(24)21-10-9-14(22)11-18(21)26-16(12-17(21)23)13-5-7-15(25-4)8-6-13/h5-10,12,18H,11H2,1-4H3
InChIKey JFAHDECMGBAGCI-UHFFFAOYSA-N
Molecular Weight 370.401 g/mol
SMILES C12(C(OC(C)(C)C)=O)C(C=C(OC2CC(C=C1)=O)c1ccc(cc1)OC)=O
SPLASH splash10-00mo-9500000000-9637b36886591f5bccbc
Source of Spectrum KC-0-168-17
Synonyms tert-Butyl 2-(4-methoxyphenyl)-4,7-dioxo-8,8a-dihydro-4H-chromene-4a(7H)-carboxylate
Wiley ID 787138