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(-)-trans-Octahydro-5.alpha.-[(2-chloro-3,5-dimethoxyphenyl)methyl]-5.beta.,8a.beta.-dimethyl-6.beta.-(hydroxymethyl)-1-naphthalenol

View entire compound with spectra: 1 MS (GC)

(-)-trans-Octahydro-5.alpha.-[(2-chloro-3,5-dimethoxyphenyl)methyl]-5.beta.,8a.beta.-dimethyl-6.beta.-(hydroxymethyl)-1-naphthalenol
SpectraBase Compound ID nsP9awvKan
InChI InChI=1S/C22H33ClO4/c1-21-9-8-15(13-24)22(2,18(21)6-5-7-19(21)25)12-14-10-16(26-3)11-17(27-4)20(14)23/h10-11,15,18-19,24-25H,5-9,12-13H2,1-4H3/t15-,18-,19+,21+,22-/m1/s1
InChIKey QYFUOYXQKZBEHC-UGFIEOPBSA-N
Mol Weight 397.0 g/mol
Molecular Formula C22H33ClO4
Exact Mass 396.206737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5l4lOnGqdrh
Name (-)-trans-Octahydro-5.alpha.-[(2-chloro-3,5-dimethoxyphenyl)methyl]-5.beta.,8a.beta.-dimethyl-6.beta.-(hydroxymethyl)-1-naphthalenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33ClO4
InChI InChI=1S/C22H33ClO4/c1-21-9-8-15(13-24)22(2,18(21)6-5-7-19(21)25)12-14-10-16(26-3)11-17(27-4)20(14)23/h10-11,15,18-19,24-25H,5-9,12-13H2,1-4H3/t15-,18-,19+,21+,22-/m1/s1
InChIKey QYFUOYXQKZBEHC-UGFIEOPBSA-N
Molecular Weight 396.955 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@@]([C@@](CO)(CC2)[H])(Cc2c(c(OC)cc(c2)OC)Cl)C)(CCC1)[H])C)[H]
SPLASH splash10-0apu-9700000000-44c911fdf7aef0d21d99
Source of Spectrum J-62-2828-17
Wiley ID 1368370