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(12R /12 S), (13S)-8,12-Epoxy-14-iodo-15-nor-labdane
SpectraBase Compound ID 27n13pGnXm8
InChI InChI=1S/C19H33IO/c1-13(12-20)14-11-16-18(4)9-6-8-17(2,3)15(18)7-10-19(16,5)21-14/h13-16H,6-12H2,1-5H3/t13-,14+,15+,16-,18+,19-/m1/s1
InChIKey CQBMTSRRIHFVKQ-ROSLGNJOSA-N
Mol Weight 404.4 g/mol
Molecular Formula C19H33IO
Exact Mass 404.157611 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GZl49mi3xFZ
Name (12R /12 S), (13S)-8,12-Epoxy-14-iodo-15-nor-labdane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H33IO
InChI InChI=1S/C19H33IO/c1-13(12-20)14-11-16-18(4)9-6-8-17(2,3)15(18)7-10-19(16,5)21-14/h13-16H,6-12H2,1-5H3/t13-,14+,15+,16-,18+,19-/m1/s1
InChIKey CQBMTSRRIHFVKQ-ROSLGNJOSA-N
Molecular Weight 404.376 g/mol
SMILES [C@]12([C@@]3([C@@](O[C@@](C3)([C@@](CI)(C)[H])[H])(C)CC[C@]1(C(C)(C)CCC2)[H])[H])C
SPLASH splash10-000f-0910000000-91fe64d2425f4dfaefd4
Source of Spectrum Y4-83-42-17
Synonyms (2S,3aR,5aS,9aS,9bR)-2-[(1S)-2-iodo-1-methylethyl]-3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan
Wiley ID 1549911