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3,9-Phenanthrenedione, 4b,5,6,7,8,8a-hexahydro-1,4-dihydroxy-4b,8,8-trimethyl-2-(1-methylethyl)-, (4bS-trans)-
SpectraBase Compound ID DPRTdge2zjh
InChI InChI=1S/C20H26O4/c1-10(2)13-15(22)11-9-12(21)18-19(3,4)7-6-8-20(18,5)14(11)17(24)16(13)23/h9-10,18,22,24H,6-8H2,1-5H3/t18-,20+/m0/s1
InChIKey SQVFZTKEIBMQQZ-AZUAARDMSA-N
Mol Weight 330.42 g/mol
Molecular Formula C20H26O4
Exact Mass 330.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7n5BoX4aXya
Name 3,9-Phenanthrenedione, 4B,5,6,7,8,8A-hexahydro-1,4-dihydroxy-4B,8,8-trimethyl-2-(1-methylethyl)-, (4bs-trans)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.183109313 u
Formula C20H26O4
InChI InChI=1S/C20H26O4/c1-10(2)13-15(22)11-9-12(21)18-19(3,4)7-6-8-20(18,5)14(11)17(24)16(13)23/h9-10,18,22,24H,6-8H2,1-5H3/t18-,20+/m0/s1
InChIKey SQVFZTKEIBMQQZ-AZUAARDMSA-N
Molecular Weight 330.424 g/mol
SMILES C1=2C(C(O)=C(C(C2O)=O)C(C)C)=CC([C@@]2([C@@]1(CCCC2(C)C)C)[H])=O