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ADBICA artifact (deamino-) MS2
SpectraBase Compound ID B9dcziu2Foj
InChI InChI=1S/C20H26N2O2/c1-5-6-9-12-22-13-16(15-10-7-8-11-17(15)22)19(24)21-18(14-23)20(2,3)4/h7-8,10-11,13,18H,5-6,9,12H2,1-4H3/p+1
InChIKey YGTMFTPFBQXEKK-UHFFFAOYSA-O
Mol Weight 327.45 g/mol
Molecular Formula C20H27N2O2
Exact Mass 327.207253 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID JF7wcPK08pI
Name ADBICA artifact (deamino-) MS2
Comments F: ITMS + c ESI d w Full ms2 327.30
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Formula C20H27N2O2
InChI InChI=1S/C20H26N2O2/c1-5-6-9-12-22-13-16(15-10-7-8-11-17(15)22)19(24)21-18(14-23)20(2,3)4/h7-8,10-11,13,18H,5-6,9,12H2,1-4H3/p+1
InChIKey YGTMFTPFBQXEKK-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C(C=1C2=C(C=CC=C2)N(C1)CCCCC)=O)C([C+]=O)C(C)(C)C
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