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Indeloxazine MS3_1
SpectraBase Compound ID 37WRHVwy0aK
InChI InChI=1S/C12H11O/c1-2-9-13-12-8-4-6-10-5-3-7-11(10)12/h2-6,8-9H,1,7H2/q+1/b9-2-
InChIKey QKGVHLFKXHVYKM-MBXJOHMKSA-N
Mol Weight 171.22 g/mol
Molecular Formula C12H11O
Exact Mass 171.08099 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID L2qx8k3KcNz
Name Indeloxazine MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-185.00]
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InChI InChI=1S/C12H11O/c1-2-9-13-12-8-4-6-10-5-3-7-11(10)12/h2-6,8-9H,1,7H2/q+1/b9-2-
InChIKey QKGVHLFKXHVYKM-MBXJOHMKSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]\C=C/OC1=C2C(=CC=C1)C=CC2
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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS