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2.alpha.-(benzoyloxy)-7.beta.-[1,1-(ethylenedioxy)ethyl]-4a.beta.-methyl-2,3,4,4a,5,6,7,8-octahydronaphthalene
SpectraBase Compound ID GMN4LSEJJ98
InChI InChI=1S/C22H28O4/c1-21-10-8-17(22(2)24-12-13-25-22)14-18(21)15-19(9-11-21)26-20(23)16-6-4-3-5-7-16/h3-7,15,17,19H,8-14H2,1-2H3/t17?,19-,21+/m1/s1
InChIKey JPIDETHKBZLFHY-FMVHKLRBSA-N
Mol Weight 356.46 g/mol
Molecular Formula C22H28O4
Exact Mass 356.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZWpVxfrI3d
Name 2.alpha.-(benzoyloxy)-7.beta.-[1,1-(ethylenedioxy)ethyl]-4a.beta.-methyl-2,3,4,4a,5,6,7,8-octahydronaphthalene
Alternate Name(s) (2R,4aS)-4a-methyl-7-(2-methyl-1,3-dioxolan-2-yl)-2,3,4,4a,5,6,7,8-octahydro-2-naphthalenyl benzoate
CAS Registry Number 93860-89-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O4
InChI InChI=1S/C22H28O4/c1-21-10-8-17(22(2)24-12-13-25-22)14-18(21)15-19(9-11-21)26-20(23)16-6-4-3-5-7-16/h3-7,15,17,19H,8-14H2,1-2H3/t17?,19-,21+/m1/s1
InChIKey JPIDETHKBZLFHY-FMVHKLRBSA-N
Molecular Weight 356.462 g/mol
SMILES C1=2[C@@](CCC(C3(OCCO3)C)C1)(CC[C@@](OC(=O)c1ccccc1)(C2)[H])C
SPLASH splash10-00di-1900000000-6c1db814b612f8f49e67
Source of Spectrum J-50-261-27
Wiley ID 1346054