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3,4-Dihydro-1H-isochromen-1-one
SpectraBase Compound ID K4EKuRyXBTb
InChI InChI=1S/C9H8O2/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-4H,5-6H2
InChIKey XVTAQSGZOGYIEY-UHFFFAOYSA-N
Mol Weight 148.16 g/mol
Molecular Formula C9H8O2
Exact Mass 148.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFs3EtT8j0w
Name 3,4-Dihydro-1H-isochromen-1-one
Alternate Name(s) 3,4,4a,8a-Tetrahydroisochroman-1-one 1H-2-Benzopyran-1-one, 3,4-dihydro- 3,4-Dihydro-1H-2-benzopyran-1-one Isochroman-1-one 3,4-Dihydroisochromen-1-one Dihydroisocoumarin EINECS 225-179-4
CAS Registry Number 4702-34-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O2
InChI InChI=1S/C9H8O2/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-4H,5-6H2
InChIKey XVTAQSGZOGYIEY-UHFFFAOYSA-N
Molecular Weight 148.161 g/mol
SMILES C1(=O)OCCc2c1cccc2
SPLASH splash10-006t-5900000000-d3e13c2ce223da142583
Wiley ID 1495606