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Azacyclonol
SpectraBase Compound ID Ew1DenTGe7C
InChI InChI=1S/C18H21NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-10,17,19-20H,11-14H2
InChIKey ZMISODWVFHHWNR-UHFFFAOYSA-N
Mol Weight 267.37 g/mol
Molecular Formula C18H21NO
Exact Mass 267.162314 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID GVvbCVKIvkd
Name Terfenadine-M (N-dealkyl-) MS2
Comments F: ITMS + c ESI d w Full ms2 268.10
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Formula C18H21NO
InChI InChI=1S/C18H21NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-10,17,19-20H,11-14H2
InChIKey ZMISODWVFHHWNR-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N1CCC(C(C=2C=CC=CC2)(C2=CC=CC=C2)O)CC1
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