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(3aR,7aS)-5-methyl-3a,6,7,7a-tetrahydro-3H-benzofuran-2-one
SpectraBase Compound ID HFjssL7S4du
InChI InChI=1S/C9H12O2/c1-6-2-3-8-7(4-6)5-9(10)11-8/h4,7-8H,2-3,5H2,1H3/t7-,8-/m0/s1
InChIKey OTHUEYHXJPVIOE-YUMQZZPRSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1prKlQN1B2x
Name (3aR,7aS)-5-methyl-3a,6,7,7a-tetrahydro-3H-benzofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c1-6-2-3-8-7(4-6)5-9(10)11-8/h4,7-8H,2-3,5H2,1H3/t7-,8-/m0/s1
InChIKey OTHUEYHXJPVIOE-YUMQZZPRSA-N
Molecular Weight 152.193 g/mol
SMILES C1(O[C@@]2([C@](C1)(C=C(CC2)C)[H])[H])=O
SPLASH splash10-01p6-9100000000-4f8b86bad1adb8f7262c
Source of Spectrum K-2001-2649-18
Synonyms (3aR,7aS)-5-methyl-3a,6,7,7a-tetrahydro-3H-1-benzofuran-2-one
Wiley ID 1579865