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(1.alpha.,4.alpha.,4a.alpha.,7.beta.,8a.beta.)-(+-)-Decahydro7-Hydroxy-4a-methyl-7-(1-methylethyl)-4-[(methylsulfonyl)oxy]-1-naphthalenecarboxaldehyde
SpectraBase Compound ID GeixfRyuxrV
InChI InChI=1S/C16H28O5S/c1-11(2)16(18)8-7-15(3)13(9-16)12(10-17)5-6-14(15)21-22(4,19)20/h10-14,18H,5-9H2,1-4H3/t12-,13-,14+,15-,16+/m1/s1
InChIKey IQCCMNHONVKTHS-LJIZCISZSA-N
Mol Weight 332.46 g/mol
Molecular Formula C16H28O5S
Exact Mass 332.165745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20X41tAxLDc
Name (1.alpha.,4.alpha.,4a.alpha.,7.beta.,8a.beta.)-(+-)-Decahydro7-Hydroxy-4a-methyl-7-(1-methylethyl)-4-[(methylsulfonyl)oxy]-1-naphthalenecarboxaldehyde
Alternate Name(s) (1S,4S,4aR,6S,8aR)-4-formyl-6-hydroxy-6-isopropyl-8a-methyldecahydro-1-naphthalenyl methanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O5S
InChI InChI=1S/C16H28O5S/c1-11(2)16(18)8-7-15(3)13(9-16)12(10-17)5-6-14(15)21-22(4,19)20/h10-14,18H,5-9H2,1-4H3/t12-,13-,14+,15-,16+/m1/s1
InChIKey IQCCMNHONVKTHS-LJIZCISZSA-N
Molecular Weight 332.455 g/mol
SMILES O[C@]1(CC[C@]2([C@@](OS(=O)(=O)C)(CC[C@](C=O)([C@]2(C1)[H])[H])[H])C)C(C)C
SPLASH splash10-052o-8950000000-bc8b17fbd0fe402b2302
Source of Spectrum J-62-7342-3
Wiley ID 1329208