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Dimethyl 8(14)-epoxy-12,13-secototara-9(11)-ene-12,13-dioate
SpectraBase Compound ID FNJkcpLNlTK
InChI InChI=1S/C22H34O5/c1-14(2)22(18(24)26-7)21(27-22)12-9-15-19(3,4)10-8-11-20(15,5)16(21)13-17(23)25-6/h13-15H,8-12H2,1-7H3/b16-13-/t15-,20-,21+,22-/m0/s1
InChIKey DRPPYUBFXWCBNW-KOWTVQILSA-N
Mol Weight 378.5 g/mol
Molecular Formula C22H34O5
Exact Mass 378.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PqgtJE92wK
Name Dimethyl 8(14)-epoxy-12,13-secototara-9(11)-ene-12,13-dioate
CAS Registry Number 122620-46-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O5
InChI InChI=1S/C22H34O5/c1-14(2)22(18(24)26-7)21(27-22)12-9-15-19(3,4)10-8-11-20(15,5)16(21)13-17(23)25-6/h13-15H,8-12H2,1-7H3/b16-13-/t15-,20-,21+,22-/m0/s1
InChIKey DRPPYUBFXWCBNW-KOWTVQILSA-N
Molecular Weight 378.509 g/mol
SMILES [C@]12([C@@](C(=O)OC)(C(C)C)O2)\C([C@]2(CCCC([C@@]2(CC1)[H])(C)C)C)=C/C(=O)OC
SPLASH splash10-004l-4090000000-a34273de3ff959409c56
Source of Spectrum B-41-1185-14
Synonyms Spiro[naphthalene-2(1H),2'-oxirane]-3'-carboxylic acid, octahydro-1-(2-methoxy-2-oxoethylidene)-5,5,8a-trimethyl-3'-(1-methylethyl)-, methyl ester, [2R-[1Z,2.alpha.(R*),4a.alpha.,8a.beta.]]- Dimethyl 9(11)-epoxy-12,13-secototara-8(14)-ene-12,13-dioate Methyl (1Z,2R,3'R,4aS,8aS)-1-(2-methoxy-2-oxoethylidene)-5,5,8a-trimethyl-3'-(propan-2-yl)-octahydro-1H-spiro[naphthalene-2,2'-oxirane]-3'-carboxylate
Wiley ID 1358875