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1(3H)-Isobenzofuranone, 4,7-dimethyl-
SpectraBase Compound ID Bhk8vPVyojn
InChI InChI=1S/C10H10O2/c1-6-3-4-7(2)9-8(6)5-12-10(9)11/h3-4H,5H2,1-2H3
InChIKey JNXGHQDZQVYCKB-UHFFFAOYSA-N
Mol Weight 162.19 g/mol
Molecular Formula C10H10O2
Exact Mass 162.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4EchF30BKg
Name 1(3H)-Isobenzofuranone, 4,7-dimethyl-
Alternate Name(s) 4,7-Dimethyl-2-benzofuran-1(3H)-one 1,3-2H-Isobenzofuran0ne, 4,7-dimethyl- 4,7-Dimethylphthalide 4,7-Dimethyl-3H-isobenzofuran-1-one
CAS Registry Number 54598-91-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2
InChI InChI=1S/C10H10O2/c1-6-3-4-7(2)9-8(6)5-12-10(9)11/h3-4H,5H2,1-2H3
InChIKey JNXGHQDZQVYCKB-UHFFFAOYSA-N
Molecular Weight 162.188 g/mol
SMILES c1cc(c2c(c1C)C(=O)OC2)C
SPLASH splash10-01q9-4900000000-fcf91b4aabfff8eff917
Source of Spectrum NP-2-364-0
Wiley ID 1100231