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18-Chloro-7-oxo-ent-kaur-16-ene
SpectraBase Compound ID B0HW1AdV1wy
InChI InChI=1S/C20H29ClO/c1-13-10-20-11-14(13)5-6-15(20)19(3)8-4-7-18(2,12-21)16(19)9-17(20)22/h14-16H,1,4-12H2,2-3H3/t14?,15-,16+,18+,19-,20-/m0/s1
InChIKey YRGFLXIODCFWLL-KGMQFNBWSA-N
Mol Weight 320.9 g/mol
Molecular Formula C20H29ClO
Exact Mass 320.190693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KH7jf1HcQpD
Name 18-Chloro-7-oxo-ent-kaur-16-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29ClO
InChI InChI=1S/C20H29ClO/c1-13-10-20-11-14(13)5-6-15(20)19(3)8-4-7-18(2,12-21)16(19)9-17(20)22/h14-16H,1,4-12H2,2-3H3/t14?,15-,16+,18+,19-,20-/m0/s1
InChIKey YRGFLXIODCFWLL-KGMQFNBWSA-N
Molecular Weight 320.904 g/mol
SMILES [C@]123[C@]([C@]4([C@]([C@@](CCl)(CCC4)C)([H])CC1=O)C)(CCC(C2)C(C3)=C)[H]
SPLASH splash10-00di-0129000000-3bc51fc8cf781f4c82fa
Source of Spectrum F-69-3009-8
Synonyms (4S,4aS,6aR,11aS,11bS)-4-(chloromethyl)-4,11b-dimethyl-8-methylenedodecahydro-6a,9-methanocyclohepta[a]naphthalen-6(2H)-one
Wiley ID 1737836