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Propoxur-M (O-dealkyl-) MS3_1
SpectraBase Compound ID F4dj2cJ6g6a
InChI InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H/p+1
InChIKey YCIMNLLNPGFGHC-UHFFFAOYSA-O
Mol Weight 111.12 g/mol
Molecular Formula C6H7O2
Exact Mass 111.044604 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID HYXMjuv0kL7
Name Propoxur-M (O-dealkyl-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-125.00]
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Formula C6H7O2
InChI InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H/p+1
InChIKey YCIMNLLNPGFGHC-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [OH2+]C=1C=CC=CC1O
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS