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8.alpha.,13-epoxy-20-iodolabda-2,14-diene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

8.alpha.,13-epoxy-20-iodolabda-2,14-diene
SpectraBase Compound ID JLkEzhyceO0
InChI InChI=1S/C20H31IO/c1-6-18(4)12-8-16-19(5,22-18)13-9-15-17(2,3)10-7-11-20(15,16)14-21/h6-7,10,15-16H,1,8-9,11-14H2,2-5H3/t15-,16-,18-,19+,20+/m0/s1
InChIKey VGQVHRHWAHOMDB-FLFBIERCSA-N
Mol Weight 414.37 g/mol
Molecular Formula C20H31IO
Exact Mass 414.141961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpEdxzANdVx
Name 8.alpha.,13-epoxy-20-iodolabda-2,14-diene
Alternate Name(s) (3R,4aR,6aS,10aR,10bR)-10a-(iodomethyl)-3,4a,7,7-tetramethyl-3-vinyl-2,3,4a,5,6,6a,7,10,10a,10b-decahydro-1H-benzo[f]chromene 8a,13-epoxy-20-iodolabda-2,14-diene
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Formula C20H31IO
InChI InChI=1S/C20H31IO/c1-6-18(4)12-8-16-19(5,22-18)13-9-15-17(2,3)10-7-11-20(15,16)14-21/h6-7,10,15-16H,1,8-9,11-14H2,2-5H3/t15-,16-,18-,19+,20+/m0/s1
InChIKey VGQVHRHWAHOMDB-FLFBIERCSA-N
Molecular Weight 414.371 g/mol
SMILES [C@]12([C@@]3([C@@](O[C@](CC3)(C=C)C)(C)CC[C@]1(C(C)(C)C=CC2)[H])[H])CI
SPLASH splash10-0002-0039200000-e7984ac249fd0d859ab8
Source of Spectrum B-44-487-0
Wiley ID 1375276