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3-Hydroxymethyl-6,6-dimethyl-2-phenyl-2,3,4,5,6,7-hexahydro-1-benzofuran-4-one
SpectraBase Compound ID GoQteiMQO7H
InChI InChI=1S/C17H20O3/c1-17(2)8-13(19)15-12(10-18)16(20-14(15)9-17)11-6-4-3-5-7-11/h3-7,12,16,18H,8-10H2,1-2H3/t12-,16-/m0/s1
InChIKey CYAJTGXYRWURTE-LRDDRELGSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 106jsi1ZLc
Name 3-Hydroxymethyl-6,6-dimethyl-2-phenyl-2,3,4,5,6,7-hexahydro-1-benzofuran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-17(2)8-13(19)15-12(10-18)16(20-14(15)9-17)11-6-4-3-5-7-11/h3-7,12,16,18H,8-10H2,1-2H3/t12-,16-/m0/s1
InChIKey CYAJTGXYRWURTE-LRDDRELGSA-N
Molecular Weight 272.344 g/mol
SMILES OC[C@]1(C2=C(O[C@]1(c1ccccc1)[H])CC(CC2=O)(C)C)[H]
SPLASH splash10-00kf-0950000000-d8df758cd30f9cd99739
Source of Spectrum KC-0-1490-14
Synonyms (2R,3R)-3-Hydroxymethyl-6,6-dimethyl-2-phenyl-2,3,4,5,6,7-hexahydro-1-benzofuran-4-one 3-(hydroxymethyl)-6,6-dimethyl-2-phenyl-3,5,6,7-tetrahydro-1-benzofuran-4(2H)-one (2R,3R)-3-(hydroxymethyl)-6,6-dimethyl-2-phenyl-2,3,5,7-tetrahydrobenzofuran-4-one (2R,3R)-3-(hydroxymethyl)-6,6-dimethyl-2-phenyl-2,3,5,7-tetrahydro-1-benzofuran-4-one
Wiley ID 786053