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Tamoxifen MS3_1
SpectraBase Compound ID 8N8L3Z8ojhZ
InChI InChI=1S/C24H23O/c1-3-23(19-15-17-22(18-16-19)25-4-2)24(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-18H,2-4H2,1H3/q+1
InChIKey JSUKJIOVLYTFNK-UHFFFAOYSA-N
Mol Weight 327.45 g/mol
Molecular Formula C24H23O
Exact Mass 327.17489 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7UANw6lnBg
Name Tamoxifen MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C24H23O/c1-3-23(19-15-17-22(18-16-19)25-4-2)24(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-18H,2-4H2,1H3/q+1
InChIKey JSUKJIOVLYTFNK-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C(=C(C1=CC=C(C=C1)OC[CH2+])CC)(C=1C=CC=CC1)C=1C=CC=CC1
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