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2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7-hydroxy-3-(hydroxymethyl)-8-methylene-5-(1- methylethyl)-, [4aS-(4a.alpha.,5.alpha.,7.beta.,8a.beta.)]-

View entire compound with spectra: 1 MS (GC)

2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7-hydroxy-3-(hydroxymethyl)-8-methylene-5-(1- methylethyl)-, [4aS-(4a.alpha.,5.alpha.,7.beta.,8a.beta.)]-
SpectraBase Compound ID BVzimQMsUJm
InChI InChI=1S/C15H22O3/c1-8(2)11-5-14(17)9(3)12-6-15(18)10(7-16)4-13(11)12/h4,8,11-14,16-17H,3,5-7H2,1-2H3/t11-,12-,13-,14+/m1/s1
InChIKey NCAPTGARIMGBLX-SYQHCUMBSA-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 GuwwxYd7T7y
Name 2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7-hydroxy-3-(hydroxymethyl)-8-methylene-5-(1- methylethyl)-, [4aS-(4a.alpha.,5.alpha.,7.beta.,8a.beta.)]-
Alternate Name(s) (4aS,5R,7S,8aS)-7-hydroxy-3-(hydroxymethyl)-5-isopropyl-8-methylene-4a,5,6,7,8,8a-hexahydro-2(1H)-naphthalenone 7.alpha.-hydroxyschizandronol
CAS Registry Number 83474-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-8(2)11-5-14(17)9(3)12-6-15(18)10(7-16)4-13(11)12/h4,8,11-14,16-17H,3,5-7H2,1-2H3/t11-,12-,13-,14+/m1/s1
InChIKey NCAPTGARIMGBLX-SYQHCUMBSA-N
Molecular Weight 250.338 g/mol
SMILES O[C@@]1(C([C@@]2([C@](C=C(CO)C(C2)=O)([C@](C1)(C(C)C)[H])[H])[H])=C)[H]
SPLASH splash10-0pbl-1920000000-4b99e1b31e0545f08b1a
Source of Spectrum F-38-1411-0
Wiley ID 1253578