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(1RS,8aRS)-1-(3-furyl)-5,8a-dimethyl-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-3-one
SpectraBase Compound ID zGRTnAVoYz
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/h5,7,9,14H,3-4,6,8H2,1-2H3
InChIKey NXNCRUBMZIZAIS-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5sy6T3dm5S
Name (1RS,8aRS)-1-(3-furyl)-5,8a-dimethyl-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-3-one
CAS Registry Number 136587-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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/h5,7,9,14H,3-4,6,8H2,1-2H3
InChIKey NXNCRUBMZIZAIS-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES C12(C(=C(C)CCC2)CC(OC1c1cocc1)=O)C
SPLASH splash10-05fr-3910000000-535d869886d621bf0592
Source of Spectrum J-56-7090-5
Synonyms 1-(3-furyl)-5,8a-dimethyl-1,4,6,7,8,8a-hexahydro-3H-2-benzopyran-3-one
Wiley ID 1249244