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Acetic acid (3aRS,7aSR)-3-(5-acetylfuran-3-yl)-3a,7,7-trimethyl-1-oxo-3a,6,7,7a-tetrahydro-1H-inden-4-yl ester
SpectraBase Compound ID 7OPQKU8flFz
InChI InChI=1S/C20H22O5/c1-11(21)16-8-13(10-24-16)14-9-15(23)18-19(3,4)7-6-17(20(14,18)5)25-12(2)22/h6,8-10,18H,7H2,1-5H3/t18-,20+/m0/s1
InChIKey MVVZIWCSLNPVNU-AZUAARDMSA-N
Mol Weight 342.39 g/mol
Molecular Formula C20H22O5
Exact Mass 342.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OZPoY5bq5s
Name Acetic acid (3aRS,7aSR)-3-(5-acetylfuran-3-yl)-3a,7,7-trimethyl-1-oxo-3a,6,7,7a-tetrahydro-1H-inden-4-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O5
InChI InChI=1S/C20H22O5/c1-11(21)16-8-13(10-24-16)14-9-15(23)18-19(3,4)7-6-17(20(14,18)5)25-12(2)22/h6,8-10,18H,7H2,1-5H3/t18-,20+/m0/s1
InChIKey MVVZIWCSLNPVNU-AZUAARDMSA-N
Molecular Weight 342.391 g/mol
SMILES [C@@]12(C(c3cc(C(=O)C)oc3)=CC([C@]1(C(CC=C2OC(=O)C)(C)C)[H])=O)C
SPLASH splash10-0a4i-9270000000-6e24e0462f604f13523e
Source of Spectrum KC-57-1055-13
Wiley ID 1622828