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(3R,3aS,7aR)-3,6-dimethyl-3a,4,5,7a-tetrahydro-3H-1-benzofuran-2-one
SpectraBase Compound ID 1uXabAZTi6b
InChI InChI=1S/C10H14O2/c1-6-3-4-8-7(2)10(11)12-9(8)5-6/h5,7-9H,3-4H2,1-2H3/t7-,8+,9+/m1/s1
InChIKey NQWBFQXRASPNLB-VGMNWLOBSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJ1iHOHuKxx
Name (3R,3aS,7aR)-3,6-dimethyl-3a,4,5,7a-tetrahydro-3H-1-benzofuran-2-one
Alternate Name(s) (3R,3aS,7aR)-3,6-dimethyl-3a,4,5,7a-tetrahydro-3H-benzofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-6-3-4-8-7(2)10(11)12-9(8)5-6/h5,7-9H,3-4H2,1-2H3/t7-,8+,9+/m1/s1
InChIKey NQWBFQXRASPNLB-VGMNWLOBSA-N
Molecular Weight 166.220 g/mol
SMILES C1(O[C@]2(C=C(C)CC[C@]2([C@]1(C)[H])[H])[H])=O
SPLASH splash10-0f96-9500000000-ecec94bb63bd10b58be1
Source of Spectrum KD-12-2987-4
Wiley ID 1634754