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5H-Oxireno[3,4]cyclopent[1,2-c]oxacyclotridecin-5-one, 3-(2-ethylcyclopropyl)-1a,2,2a,3,6,7,8,11,13a,13b-decahydro-, [1aS-[1aR*,2aS*,3R*(1S*,2R*),9Z,12Z,13aR*,13bS*]]-
SpectraBase Compound ID A8tiBEJQZPG
InChI InChI=1S/C20H28O3/c1-2-13-11-15(13)19-16-12-17-20(22-17)14(16)9-7-5-3-4-6-8-10-18(21)23-19/h3-4,7,9,13-17,19-20H,2,5-6,8,10-12H2,1H3/b4-3-,9-7-/t13-,14-,15+,16+,17-,19-,20+/m0/s1
InChIKey YJRNYEWLGNTSHT-SRHJZBNWSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rFrkGIhEy8
Name 5H-Oxireno[3,4]cyclopent[1,2-c]oxacyclotridecin-5-one, 3-(2-ethylcyclopropyl)-1a,2,2a,3,6,7,8,11,13a,13b-decahydro-, [1aS-[1aR*,2aS*,3R*(1S*,2R*),9Z,12Z,13aR*,13bS*]]-
Alternate Name(s) (1aS,2aR,3S,13aS,13bR)-3-[(1R,2S)-2-ethylcyclopropyl]-1a,2,2a,3,6,7,8,11,13a,13b-decahydro-5H-oxireno[2',3':3,4]cyclopenta[1,2-c]oxacyclotridecin-5-one Hybridalactone
CAS Registry Number 81892-88-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-2-13-11-15(13)19-16-12-17-20(22-17)14(16)9-7-5-3-4-6-8-10-18(21)23-19/h3-4,7,9,13-17,19-20H,2,5-6,8,10-12H2,1H3/b4-3-,9-7-/t13-,14-,15+,16+,17-,19-,20+/m0/s1
InChIKey YJRNYEWLGNTSHT-SRHJZBNWSA-N
Molecular Weight 316.441 g/mol
SMILES [C@@]12(O[C@]1(C[C@]1([C@@](OC(CCC\C=C/C\C=C/[C@]21[H])=O)([C@@]1(C[C@@]1(CC)[H])[H])[H])[H])[H])[H]
SPLASH splash10-05ox-9200000000-e1dbe55f836c8bad37d6
Source of Spectrum F-37-4262-0
Wiley ID 1317066