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Amprenavir MS2
SpectraBase Compound ID AxnFhZg54Iz
InChI InChI=1S/C25H35N3O6S/c1-18(2)15-28(35(31,32)22-10-8-20(26)9-11-22)16-24(29)23(14-19-6-4-3-5-7-19)27-25(30)34-21-12-13-33-17-21/h3-11,18,21,23-24,29H,12-17,26H2,1-2H3,(H,27,30)
InChIKey YMARZQAQMVYCKC-UHFFFAOYSA-N
Mol Weight 505.6 g/mol
Molecular Formula C25H35N3O6S
Exact Mass 505.224657 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID KjcZ0YRV9aB
Name Amprenavir MS2
Comments F: ITMS + c ESI d w Full ms2 506.10
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Formula C25H35N3O6S
InChI InChI=1S/C25H35N3O6S/c1-18(2)15-28(35(31,32)22-10-8-20(26)9-11-22)16-24(29)23(14-19-6-4-3-5-7-19)27-25(30)34-21-12-13-33-17-21/h3-11,18,21,23-24,29H,12-17,26H2,1-2H3,(H,27,30)
InChIKey YMARZQAQMVYCKC-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES NC1=CC=C(S(N(CC(C(NC(=O)OC2CCOC2)CC2=CC=CC=C2)O)CC(C)C)(=O)=O)C=C1
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 ms2
Technique ITMS