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1(3H)-Isobenzofuranone, 3a,4,7,7a-tetrahydro-3-methyl-, [3R-(3.alpha.,3a.alpha.,7a.alpha.)]-
SpectraBase Compound ID JQUEqcFJlbE
InChI InChI=1S/C9H12O2/c1-6-7-4-2-3-5-8(7)9(10)11-6/h2-3,6-8H,4-5H2,1H3/t6-,7-,8-/m1/s1
InChIKey MVEMVBBWWHXEGT-BWZBUEFSSA-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 B87KJYiCEHG
Name 1(3H)-Isobenzofuranone, 3a,4,7,7a-tetrahydro-3-methyl-, [3R-(3.alpha.,3a.alpha.,7a.alpha.)]-
Alternate Name(s) (1R,6S,7R)-7-Methyl-8-oxabicyclo[4.3.0]non-3-en-9-one (3R,3aS,7aR)-3-methyl-3a,4,7,7a-tetrahydro-2-benzofuran-1(3H)-one
CAS Registry Number 106862-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c1-6-7-4-2-3-5-8(7)9(10)11-6/h2-3,6-8H,4-5H2,1H3/t6-,7-,8-/m1/s1
InChIKey MVEMVBBWWHXEGT-BWZBUEFSSA-N
Molecular Weight 152.193 g/mol
SMILES C1(O[C@](C)([C@@]2([C@]1(CC=CC2)[H])[H])[H])=O
SPLASH splash10-004l-9200000000-c0c383f9909cdcd9b0a3
Source of Spectrum F-44-1717-10
Wiley ID 1149092