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(6E,10Z)-(3S,3aS,9S,11aR)-9-Hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]fur
SpectraBase Compound ID GrxJfOKCWNJ
InChI InChI=1S/C15H22O3/c1-9-4-6-12-11(3)15(17)18-14(12)8-10(2)13(16)7-5-9/h5,8,11-14,16H,4,6-7H2,1-3H3/b9-5+,10-8-/t11-,12-,13-,14-/m0/s1
InChIKey RLHPCSSGTQNSJN-JZVGDANUSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuL6MBDUltm
Name (6E,10Z)-(3S,3aS,9S,11aR)-9-Hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]fur
Alternate Name(s) 3.beta.-Hydroxy-6,11.beta.(H),7.alpha.(H)-germacra-1(10)E,4(5)Z-dien-6,12-olide Deacetyl-ajanolide A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-9-4-6-12-11(3)15(17)18-14(12)8-10(2)13(16)7-5-9/h5,8,11-14,16H,4,6-7H2,1-3H3/b9-5+,10-8-/t11-,12-,13-,14-/m0/s1
InChIKey RLHPCSSGTQNSJN-JZVGDANUSA-N
Molecular Weight 250.338 g/mol
SMILES O[C@@]1(\C(=C/[C@@]2(OC([C@]([C@@]2(CC\C(=C\C1)C)[H])(C)[H])=O)[H])C)[H]
SPLASH splash10-0kft-6940000000-fc33ce6e1be9c712c4ad
Source of Spectrum X3-35-59-2
Wiley ID 1691796