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8.alpha.,13-Epoxy-20-iodolabdan-14-en-2-one
SpectraBase Compound ID Ey8sNsqVJwT
InChI InChI=1S/C20H31IO2/c1-6-18(4)9-7-16-19(5,23-18)10-8-15-17(2,3)11-14(22)12-20(15,16)13-21/h6,15-16H,1,7-13H2,2-5H3/t15-,16?,18-,19+,20+/m0/s1
InChIKey RQGNWFAMHOLCFL-AEOXZHQRSA-N
Mol Weight 430.37 g/mol
Molecular Formula C20H31IO2
Exact Mass 430.136875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rdV0L1pRdt
Name 8.alpha.,13-Epoxy-20-iodolabdan-14-en-2-one
Alternate Name(s) (3R,4aR,6aS,10aS,10bR)-4a-(iodomethyl)-3,7,7,10a-tetramethyl-3-vinyldodecahydro-9H-benzo[f]chromen-9-one 8a,13-epoxy-20-iodolabd-14-en-2-one
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Formula C20H31IO2
InChI InChI=1S/C20H31IO2/c1-6-18(4)9-7-16-19(5,23-18)10-8-15-17(2,3)11-14(22)12-20(15,16)13-21/h6,15-16H,1,7-13H2,2-5H3/t15-,16?,18-,19+,20+/m0/s1
InChIKey RQGNWFAMHOLCFL-AEOXZHQRSA-N
Molecular Weight 430.370 g/mol
SMILES [C@]12(C3[C@@](O[C@](CC3)(C=C)C)(C)CC[C@]1(C(C)(C)CC(C2)=O)[H])CI
SPLASH splash10-014j-0025900000-fe7e6184e6cd92dc943e
Source of Spectrum B-44-487-0
Wiley ID 1381420