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Ranitidine MS3_2
SpectraBase Compound ID 14OzQ3nwgjK
InChI InChI=1S/C5H9N3O2S/c1-6-5(4-8(9)10)7-2-3-11/h3-4,6-7H,2H2,1H3/p+1/b5-4+
InChIKey GYRSKRKPMRXNQR-SNAWJCMRSA-O
Mol Weight 176.21 g/mol
Molecular Formula C5H10N3O2S
Exact Mass 176.049373 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID Li6yHm3LEI1
Name Ranitidine MS3_2
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C5H9N3O2S/c1-6-5(4-8(9)10)7-2-3-11/h3-4,6-7H,2H2,1H3/p+1/b5-4+
InChIKey GYRSKRKPMRXNQR-SNAWJCMRSA-O
Ion Polarity P
Ionization Type ESI
SMILES [SH+]=CCN\C(=C\N(=O)=O)NC
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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS