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Medazepam
SpectraBase Compound ID GaolKlwzmUz
InChI InChI=1S/C16H15ClN2/c1-19-10-9-18-16(12-5-3-2-4-6-12)14-11-13(17)7-8-15(14)19/h2-8,11H,9-10H2,1H3
InChIKey YLCXGBZIZBEVPZ-UHFFFAOYSA-N
Mol Weight 270.76 g/mol
Molecular Formula C16H15ClN2
Exact Mass 270.092376 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DlLHbdwZa1W
Name Medazepam
CAS Registry Number 2898-12-6
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-295.00]
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Formula C16H15ClN2
InChI InChI=1S/C16H15ClN2/c1-19-10-9-18-16(12-5-3-2-4-6-12)14-11-13(17)7-8-15(14)19/h2-8,11H,9-10H2,1H3
InChIKey YLCXGBZIZBEVPZ-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES C=1(C=CC=CC1)C1=NCCN(C=2C1=CC(=CC2)Cl)C
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge 1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD