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Spiro[6H-benz[e]indene-6,3'(6'H)-[2H]pyran]-6'-one, 7-[(acetyloxy)methyl]tetradecahydro-3-hydroxy-3a-methyl-, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.alpha.,7.beta.,9a.alpha.,9b.beta.)]-
SpectraBase Compound ID HG9mPbuOdJc
InChI InChI=1S/C21H32O5/c1-13(22)25-11-14-3-4-15-16-5-6-18(23)20(16,2)9-7-17(15)21(14)10-8-19(24)26-12-21/h14-18,23H,3-12H2,1-2H3/t14-,15+,16+,17+,18+,20+,21-/m1/s1
InChIKey FVWFIWRGJPVGNR-LBPHSLBSSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ee8jOsvZ8JN
Name Spiro[6H-benz[E]indene-6,3'(6'H)-[2H]pyran]-6'-one, 7-[(acetyloxy)methyl]tetradecahydro-3-hydroxy-3A-methyl-, [3S-(3.alpha.,3A.alpha.,5A.beta.,6.alpha.,7.beta.,9A.alpha.,9B.beta.)]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.224974125 u
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-13(22)25-11-14-3-4-15-16-5-6-18(23)20(16,2)9-7-17(15)21(14)10-8-19(24)26-12-21/h14-18,23H,3-12H2,1-2H3/t14-,15+,16+,17+,18+,20+,21-/m1/s1
InChIKey FVWFIWRGJPVGNR-LBPHSLBSSA-N
Molecular Weight 364.482 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(O)[H])[H])([H])CC[C@@]2(COC(=O)C)[H])[H])COC(CC1)=O