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(1rs,5rs,8Asr)-1-(3-furyl)-5,8A-dimethyl-1,5,6,7,8,8A-hexahydro-3H-2-benzopyran-3-one

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(1rs,5rs,8Asr)-1-(3-furyl)-5,8A-dimethyl-1,5,6,7,8,8A-hexahydro-3H-2-benzopyran-3-one
SpectraBase Compound ID CAD7GRXkDZ4
InChI InChI=1S/C15H18O3/c1-10-4-3-6-15(2)12(10)8-13(16)18-14(15)11-5-7-17-9-11/h5,7-10,14H,3-4,6H2,1-2H3
InChIKey YJHKASLCUFUXBQ-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DKXDYmh24CM
Name (1rs,5rs,8Asr)-1-(3-furyl)-5,8A-dimethyl-1,5,6,7,8,8A-hexahydro-3H-2-benzopyran-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.125594437 u
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-10-4-3-6-15(2)12(10)8-13(16)18-14(15)11-5-7-17-9-11/h5,7-10,14H,3-4,6H2,1-2H3
InChIKey YJHKASLCUFUXBQ-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES C12(C(=CC(OC2C2=COC=C2)=O)C(C)CCC1)C