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5-Acetoxy-7a-methyl-2,3,3a,4,5,7a-hexahydro-(3a.alpha.,5.beta.,7a.alpha.)-benzofuran
SpectraBase Compound ID 7I5zJWs3taN
InChI InChI=1S/C11H16O3/c1-8(12)14-10-3-5-11(2)9(7-10)4-6-13-11/h3,5,9-10H,4,6-7H2,1-2H3/t9-,10-,11+/m1/s1
InChIKey SZXBDVIYWZLPAH-MXWKQRLJSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8uWvGlopgtB
Name 5-Acetoxy-7a-methyl-2,3,3a,4,5,7a-hexahydro-(3a.alpha.,5.beta.,7a.alpha.)-benzofuran
Alternate Name(s) (3aR,5S,7aR)-7a-methyl-2,3,3a,4,5,7a-hexahydro-1-benzofuran-5-yl acetate
CAS Registry Number 141612-42-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-8(12)14-10-3-5-11(2)9(7-10)4-6-13-11/h3,5,9-10H,4,6-7H2,1-2H3/t9-,10-,11+/m1/s1
InChIKey SZXBDVIYWZLPAH-MXWKQRLJSA-N
Molecular Weight 196.246 g/mol
SMILES [C@]12(C=C[C@](C[C@]2(CCO1)[H])(OC(=O)C)[H])C
SPLASH splash10-0596-6900000000-9e5885d42616c02973a3
Source of Spectrum C-114-6379-13
Wiley ID 1193238