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3-oxo-1-phthalanacetic acid
SpectraBase Compound ID 35hoLboI5Ij
InChI InChI=1S/C10H8O4/c11-9(12)5-8-6-3-1-2-4-7(6)10(13)14-8/h1-4,8H,5H2,(H,11,12)
InChIKey FJWKEFBYCZSVNZ-UHFFFAOYSA-N
Mol Weight 192.17 g/mol
Molecular Formula C10H8O4
Exact Mass 192.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50Gm8VJO3uA
Name (3-oxo-1,3-dihydro-2-benzofuran-1-yl)acetic acid
Alternate Name(s) 2-(3-oxidanylidene-1H-2-benzofuran-1-yl)ethanoic acid 2-(3-oxo-1H-2-benzofuran-1-yl)acetic acid 2-(3-oxo-1H-isobenzofuran-1-yl)acetic acid 2-Phthalidylacetic acid
CAS Registry Number 4743-58-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O4
InChI InChI=1S/C10H8O4/c11-9(12)5-8-6-3-1-2-4-7(6)10(13)14-8/h1-4,8H,5H2,(H,11,12)
InChIKey FJWKEFBYCZSVNZ-UHFFFAOYSA-N
Molecular Weight 192.170 g/mol
SMILES OC(CC1OC(c2c1cccc2)=O)=O
SPLASH splash10-000t-1900000000-bcec47f7bebf2ea1a7e7
Source of Spectrum MZ-34-1187-6
Wiley ID 1582136