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A-834.735-M (HO-) isomer 2 MS3_2
SpectraBase Compound ID FZerqFutJ0T
InChI InChI=1S/C15H16NO2/c17-11-13-10-16(9-12-5-7-18-8-6-12)15-4-2-1-3-14(13)15/h1-4,10,12H,5-9H2/q+1
InChIKey BYEUCXMSPQCJSB-UHFFFAOYSA-N
Mol Weight 242.3 g/mol
Molecular Formula C15H16NO2
Exact Mass 242.118104 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID KoKYRANLVrB
Name A-834.735 MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-255.00]
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Formula C15H16NO2
InChI InChI=1S/C15H16NO2/c17-11-13-10-16(9-12-5-7-18-8-6-12)15-4-2-1-3-14(13)15/h1-4,10,12H,5-9H2/q+1
InChIKey BYEUCXMSPQCJSB-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C(C1=CN(C2=C1C=CC=C2)CC1CCOCC1)#[O+]
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