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Carteolol-M (HO-) MS2
SpectraBase Compound ID 9EcwrKV8WiY
InChI InChI=1S/C16H24N2O4/c1-16(2,3)17-8-10(19)9-22-13-6-5-12(20)15-11(13)4-7-14(21)18-15/h5-6,10,17,19-20H,4,7-9H2,1-3H3,(H,18,21)
InChIKey TVZJLAKRXHGVOK-UHFFFAOYSA-N
Mol Weight 308.38 g/mol
Molecular Formula C16H24N2O4
Exact Mass 308.173607 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 6Ap7w2fZ6e
Name Carteolol-M (HO-) MS2
Comments F: ITMS + c ESI d w Full ms2 309.10
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Formula C16H24N2O4
InChI InChI=1S/C16H24N2O4/c1-16(2,3)17-8-10(19)9-22-13-6-5-12(20)15-11(13)4-7-14(21)18-15/h5-6,10,17,19-20H,4,7-9H2,1-3H3,(H,18,21)
InChIKey TVZJLAKRXHGVOK-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C(C)(C)C)CC(COC=1C2=C(C(=CC1)O)NC(CC2)=O)O
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 ms2
Technique ITMS