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1H-Cyclobuta[de]naphthalene-1,2-dimethanol, 1a,4,4a,5,6,7,7a,7b-octahydro-1-(5-hydroxy-4-methyl-3-pentenyl)-5-methyl-, [1R-[1.alpha.,1(E),1a.alpha.,4a.alpha.,5.beta.,7a.alpha.,7b.alpha.]]-
SpectraBase Compound ID 8dD2y0hCdiX
InChI InChI=1S/C20H32O3/c1-13(10-21)4-3-9-20(12-23)17-8-5-14(2)16-7-6-15(11-22)19(20)18(16)17/h4,6,14,16-19,21-23H,3,5,7-12H2,1-2H3/b13-4+/t14-,16-,17+,18-,19?,20-/m1/s1
InChIKey XWUIGIQNNFPWFK-BOBUWCAXSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2H6JYCgiqF
Name 1H-Cyclobuta[de]naphthalene-1,2-dimethanol, 1a,4,4a,5,6,7,7a,7b-octahydro-1-(5-hydroxy-4-methyl-3-pentenyl)-5-methyl-, [1R-[1.alpha.,1(E),1a.alpha.,4a.alpha.,5.beta.,7a.alpha.,7b.alpha.]]-
Alternate Name(s) (2E)-5-[(1R,1aS,4R,4aR,7bR)-1,7-bis(hydroxymethyl)-4-methyl-1a,2,3,4,4a,5,7a,7b-octahydro-1H-cyclobuta[de]naphthalen-1-yl]-2-methyl-2-penten-1-ol 1,18,19-Trihydroxy-decipi-2(4),14-diene
CAS Registry Number 77982-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-13(10-21)4-3-9-20(12-23)17-8-5-14(2)16-7-6-15(11-22)19(20)18(16)17/h4,6,14,16-19,21-23H,3,5,7-12H2,1-2H3/b13-4+/t14-,16-,17+,18-,19?,20-/m1/s1
InChIKey XWUIGIQNNFPWFK-BOBUWCAXSA-N
Molecular Weight 320.473 g/mol
SMILES OCC=1C2[C@@](CC\C=C\(CO)C)([C@@]3([C@]2([C@](CC1)([C@@](CC3)(C)[H])[H])[H])[H])CO
SPLASH splash10-0ue9-0093000000-94d9e264e82883ba2ab8
Source of Spectrum F-36-3256-0
Wiley ID 1320413