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Rabeprazole MS3_1
SpectraBase Compound ID D2Qip4FLGLt
InChI InChI=1S/C11H16NO3S/c1-9-10(8-16-13)12-5-4-11(9)15-7-3-6-14-2/h4-5H,3,6-8H2,1-2H3/q+1
InChIKey BWKMXKBFGVABOF-UHFFFAOYSA-N
Mol Weight 242.31 g/mol
Molecular Formula C11H16NO3S
Exact Mass 242.08509 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 6QE4Qjgv9CU
Name Rabeprazole MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-255.00]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C11H16NO3S/c1-9-10(8-16-13)12-5-4-11(9)15-7-3-6-14-2/h4-5H,3,6-8H2,1-2H3/q+1
InChIKey BWKMXKBFGVABOF-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C([S+]=O)C1=NC=CC(=C1C)OCCCOC
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