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(2S,3R,3aS,7aS)-2-butyl-3-iodanyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
SpectraBase Compound ID 79MwlvIGh1A
InChI InChI=1S/C12H21IO/c1-2-3-7-11-12(13)9-6-4-5-8-10(9)14-11/h9-12H,2-8H2,1H3/t9-,10-,11-,12+/m0/s1
InChIKey MZOQCZLUJMSQOF-FIQHERPVSA-N
Mol Weight 308.2 g/mol
Molecular Formula C12H21IO
Exact Mass 308.06371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EuHL9Ozq4
Name (2S,3R,3aS,7aS)-2-butyl-3-iodanyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21IO
InChI InChI=1S/C12H21IO/c1-2-3-7-11-12(13)9-6-4-5-8-10(9)14-11/h9-12H,2-8H2,1H3/t9-,10-,11-,12+/m0/s1
InChIKey MZOQCZLUJMSQOF-FIQHERPVSA-N
Molecular Weight 308.203 g/mol
SMILES [C@@]12(O[C@]([C@@]([C@]2(CCCC1)[H])(I)[H])(CCCC)[H])[H]
SPLASH splash10-00ea-7930000000-ef26cb04dcb69dc63941
Source of Spectrum KC-0-3474-18
Synonyms (2S,3R,3aS,7aS)-2-butyl-3-iodo-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran (2S,3R,3aS,7aS)-2-butyl-3-iodo-2,3,3a,4,5,6,7,7a-octahydrobenzofuran
Wiley ID 831882