SpectraBase Compound ID | GljHLJjLBEb |
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InChI | InChI=1S/4C18H18N2O2/c1-18(2,12-7-4-3-5-8-12)20-17(22)13-11-19-14-9-6-10-15(21)16(13)14;1-18(2,12-7-4-3-5-8-12)20-17(22)14-11-19-16-13(14)9-6-10-15(16)21;1-18(2,12-6-4-3-5-7-12)20-17(22)15-11-19-16-9-8-13(21)10-14(15)16;1-18(2,12-6-4-3-5-7-12)20-17(22)15-11-19-16-10-13(21)8-9-14(15)16/h4*3-11,19,21H,1-2H3,(H,20,22) |
InChIKey | GSBLSVPFCAQQCG-UHFFFAOYSA-N |
Mol Weight | 294.35 g/mol |
Molecular Formula | C18H18N2O2 |
Exact Mass | 294.136828 g/mol |
SpectraBase Spectrum ID | 9V4KTVFv5E |
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Name | Cumyl-PICA-M (N-dealkyl-HO-) MS2 |
Comments | F: ITMS + c ESI d w Full ms2 295.30 |
Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula | C18H18N2O2 |
Ion Polarity | P |
Ionization Type | ESI |
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: Metabolite |
Source of Spectrum | Maurer/Wissenbach/Weber, Saarland University |
Spectrum Type | ms2 |
Technique | ITMS |