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Quetiapine-M (di-HO-) MS2
SpectraBase Compound ID JEUnlRbcolf
InChI InChI=1S/6C21H25N3O4S/c25-10-12-28-11-9-23-5-7-24(8-6-23)21-16-3-1-2-4-19(16)29-20-17(22-21)13-15(26)14-18(20)27;25-10-12-28-11-9-23-5-7-24(8-6-23)21-16-3-1-2-4-18(16)29-19-14-15(26)13-17(27)20(19)22-21;25-10-12-28-11-9-23-5-7-24(8-6-23)21-15-3-1-2-4-19(15)29-20-14-18(27)17(26)13-16(20)22-21;25-12-14-28-13-11-23-7-9-24(10-8-23)21-15-3-1-2-4-18(15)29-20-16(22-21)5-6-17(26)19(20)27;25-12-14-28-13-11-23-7-9-24(10-8-23)21-15-3-1-2-4-18(15)29-20-17(27)6-5-16(26)19(20)22-21;25-12-14-28-13-11-23-7-9-24(10-8-23)21-15-3-1-2-4-17(15)29-18-6-5-16(26)20(27)19(18)22-21/h3*1-4,13-14,25-27H,5-12H2;3*1-6,25-27H,7-14H2
InChIKey NCLVVSHYGUZHHB-UHFFFAOYSA-N
Mol Weight 415.51 g/mol
Molecular Formula C21H25N3O4S
Exact Mass 415.156577 g/mol
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Technique HCD
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
  • Quetiapine-M (di-HO-)
  • Quetiapine-M (di-HO-sulfate) MS3_1
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