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10-chloro-11b-(o-chlorophenyl)-2,3,5,11b-tetrahydrooxazolo[3,2-b][1,4]benzodiazepin-6(7H)-one
SpectraBase Compound ID 3483RpFxLKt
InChI InChI=1S/C17H14Cl2N2O2/c18-11-5-6-15-13(9-11)17(12-3-1-2-4-14(12)19)21(7-8-23-17)10-16(22)20-15/h1-6,9H,7-8,10H2,(H,20,22)
InChIKey ZIXNZOBDFKSQTC-UHFFFAOYSA-N
Mol Weight 349.22 g/mol
Molecular Formula C17H14Cl2N2O2
Exact Mass 348.043233 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID uSgQqSSu70
Name Cloxazolam
CAS Registry Number 24166-13-0
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-375.00]
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Formula C17H14Cl2N2O2
InChI InChI=1S/C17H14Cl2N2O2/c18-11-5-6-15-13(9-11)17(12-3-1-2-4-14(12)19)21(7-8-23-17)10-16(22)20-15/h1-6,9H,7-8,10H2,(H,20,22)
InChIKey ZIXNZOBDFKSQTC-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES N1C(CN2CCOC2(C2=C1C=CC(=C2)Cl)C1=C(C=CC=C1)Cl)=O
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