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10H-phenothiazine
SpectraBase Compound ID 2cY6CXD9YOo
InChI InChI=1S/C12H9NS/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-8,13H
InChIKey WJFKNYWRSNBZNX-UHFFFAOYSA-N
Mol Weight 199.27 g/mol
Molecular Formula C12H9NS
Exact Mass 199.04557 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID KfsoP9pozMF
Name Phenothiazine
CAS Registry Number 92-84-2
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-220.00]
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Formula C12H9NS
InChI InChI=1S/C12H9NS/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-8,13H
InChIKey WJFKNYWRSNBZNX-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES N1C2=CC=CC=C2SC2=CC=CC=C12
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