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(E)-(4aR,5S,8S,8aR,9aS)-9a-methoxy-3,4a,5-trimethyl-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate

View entire compound with spectra: 1 MS (GC)

(E)-(4aR,5S,8S,8aR,9aS)-9a-methoxy-3,4a,5-trimethyl-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate
SpectraBase Compound ID BZw5c4SuLj0
InChI InChI=1S/C21H30O5/c1-7-12(2)18(22)25-17-9-8-13(3)20(5)10-15-14(4)19(23)26-21(15,24-6)11-16(17)20/h7,13,16-17H,8-11H2,1-6H3/b12-7+/t13-,16-,17-,20+,21-/m0/s1
InChIKey VZDRWGCKZZURIO-SWHMLOQMSA-N
Mol Weight 362.47 g/mol
Molecular Formula C21H30O5
Exact Mass 362.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2IxDP8fbdY
Name (E)-(4aR,5S,8S,8aR,9aS)-9a-methoxy-3,4a,5-trimethyl-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate
Alternate Name(s) (4aR,5S,8S,8aR,9aS)-9a-methoxy-3,4a,5-trimethyl-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl (E)-2-methylbut-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O5
InChI InChI=1S/C21H30O5/c1-7-12(2)18(22)25-17-9-8-13(3)20(5)10-15-14(4)19(23)26-21(15,24-6)11-16(17)20/h7,13,16-17H,8-11H2,1-6H3/b12-7+/t13-,16-,17-,20+,21-/m0/s1
InChIKey VZDRWGCKZZURIO-SWHMLOQMSA-N
Molecular Weight 362.466 g/mol
SMILES C1C[C@@]([C@@]2([C@]([C@]1(OC(=O)\C(=C\C)C)[H])(C[C@]1(C(C2)=C(C(O1)=O)C)OC)[H])C)(C)[H]
SPLASH splash10-001i-9240000000-8233aba7ec25561932f6
Source of Spectrum Liliana Ruiz-Vasquez, et al. Phytochemistry, V.117, 2015, P.245-253
Wiley ID 1815314