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JWH-015-M (HO-) isomer 3 MS3_1
SpectraBase Compound ID Icto5lkunrZ
InChI InChI=1S/C20H13NO/c1-13-19(17-10-4-5-12-18(17)21-13)20(22)16-11-6-8-14-7-2-3-9-15(14)16/h2-12H,1H2/p+1
InChIKey SXHHZJGHDDDRIW-UHFFFAOYSA-O
Mol Weight 284.34 g/mol
Molecular Formula C20H14NO
Exact Mass 284.107539 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID AwlUaiJRMjg
Name JWH-015-M (HO-) isomer 3 MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [65.00-295.00]
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Formula C20H14NO
InChI InChI=1S/C20H13NO/c1-13-19(17-10-4-5-12-18(17)21-13)20(22)16-11-6-8-14-7-2-3-9-15(14)16/h2-12H,1H2/p+1
InChIKey SXHHZJGHDDDRIW-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N1C(=C(C=2C1=CC=CC2)C(C1=C2C(C=CC=C2)=CC=C1)=O)[CH2+]
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 ms3
Technique ITMS