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LSD-M (nor-) MS3_1
SpectraBase Compound ID kq9bOREbU4
InChI InChI=1S/C15H13N2O/c18-8-9-4-12-11-2-1-3-13-15(11)10(7-17-13)5-14(12)16-6-9/h1-4,7,9,14,16-17H,5-6H2/q+1
InChIKey IFKBCUNZWRRBAT-UHFFFAOYSA-N
Mol Weight 237.28 g/mol
Molecular Formula C15H13N2O
Exact Mass 237.102788 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID H2nLzYRscpu
Name ETH-LAD MS3_2
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-250.00]
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InChI InChI=1S/C15H13N2O/c18-8-9-4-12-11-2-1-3-13-15(11)10(7-17-13)5-14(12)16-6-9/h1-4,7,9,14,16-17H,5-6H2/q+1
InChIKey IFKBCUNZWRRBAT-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N1C=C2C=3C(C=4C(C2)NCC(C4)[C+]=O)=CC=CC13
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