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Hydrocoumarin
SpectraBase Compound ID DH5Cz3XNvG9
InChI InChI=1S/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H2
InChIKey VMUXSMXIQBNMGZ-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 GU6vm32OJPc
Name 2-Chromanone
CAS Registry Number 119-84-6
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 148.052429496 u
Formula C9H8O2
InChI InChI=1S/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H2
InChIKey VMUXSMXIQBNMGZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 148.161 g/mol
Nominal Mass 148 u
Quality 1000
Retention Index 1120
SMILES C12=C(CCC(O2)=O)C=CC=C1
SPLASH splash10-006w-8900000000-3b50270bf0af03691050
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Dihydrocoumarine 3,4-dihydro-2H-chromen-2-one
Technique GC/MS
Wiley ID DD2024_032279