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4-Chlorocoumarin
SpectraBase Compound ID 7oT5FRNt1xZ
InChI InChI=1S/C9H5ClO2/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5H
InChIKey RKEYJFRSDLEQIE-UHFFFAOYSA-N
Mol Weight 180.59 g/mol
Molecular Formula C9H5ClO2
Exact Mass 179.997807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bvaA5QqtU
Name 4-Chlorocoumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5ClO2
InChI InChI=1S/C9H5ClO2/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5H
InChIKey RKEYJFRSDLEQIE-UHFFFAOYSA-N
Instrument Name AEI MS 902 S
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.610
Molecular Weight 180.590 g/mol
Quality 500
SMILES C1(Cl)=CC(OC2=C1C=CC=C2)=O
SPLASH splash10-0w39-6900000000-13d9e02249fad9b7f525
Source of Spectrum ARK-2001-103-2a (DOI: 10.3998/ark.5550190.0002.610)
Wiley ID 1908777