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5(R),17(S*)-Dihydroxyspata-13,18-diene
SpectraBase Compound ID DoghtSAGWkz
InChI InChI=1S/C20H32O2/c1-11(2)16(21)9-7-12(3)14-10-17(22)20(5)15-8-6-13(4)18(15)19(14)20/h13-19,21-22H,1,3,6-10H2,2,4-5H3/t13-,14+,15+,16+,17-,18-,19+,20+/m1/s1
InChIKey XISXUUCUYHRCSN-XYQAPHKRSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1K4EwqvySwU
Name 5(R),17(S*)-Dihydroxyspata-13,18-diene
CAS Registry Number 77136-64-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-11(2)16(21)9-7-12(3)14-10-17(22)20(5)15-8-6-13(4)18(15)19(14)20/h13-19,21-22H,1,3,6-10H2,2,4-5H3/t13-,14+,15+,16+,17-,18-,19+,20+/m1/s1
InChIKey XISXUUCUYHRCSN-XYQAPHKRSA-N
Molecular Weight 304.474 g/mol
SMILES O[C@@](CCC([C@]1([C@@]2([C@]([C@@](C1)(O)[H])([C@@]1([C@]2([C@@](CC1)(C)[H])[H])[H])C)[H])[H])=C)(C(=C)C)[H]
SPLASH splash10-0ff3-9730000000-1a45f31bf6a5791f1edb
Source of Spectrum J-46-2239-0
Synonyms (1R,3R,3aR,3bR,4R,6aS,6bR)-3-[(4S)-4-hydroxy-5-methyl-1-methylene-5-hexenyl]-4,6b-dimethyldecahydrocyclopenta[3,4]cyclobuta[1,2-a]cyclopenten-1-ol
Wiley ID 1306859