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Dibenzepin-M (di-HO-) MS3_1
SpectraBase Compound ID C4UhWow3Bgr
InChI InChI=1S/C16H14N2O2/c1-3-18-14-7-5-4-6-13(14)17(2)15-10-11(19)8-9-12(15)16(18)20/h4-10H,1,3H2,2H3/p+1
InChIKey QBSNYVPUOKRRKH-UHFFFAOYSA-O
Mol Weight 267.31 g/mol
Molecular Formula C16H15N2O2
Exact Mass 267.113353 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID HoSAjuvK3ti
Name Dibenzepin-M (di-HO-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-280.00]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C16H14N2O2/c1-3-18-14-7-5-4-6-13(14)17(2)15-10-11(19)8-9-12(15)16(18)20/h4-10H,1,3H2,2H3/p+1
InChIKey QBSNYVPUOKRRKH-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES OC1=CC2=C(C(N(C[CH2+])C3=C(N2C)C=CC=C3)=O)C=C1
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