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Cinchocaine MS3_1
SpectraBase Compound ID 8qWsfLK7puo
InChI InChI=1S/C16H18N2O2/c1-3-5-10-20-15-11-13(16(19)17-4-2)12-8-6-7-9-14(12)18-15/h6-9,11H,2-5,10H2,1H3/p+1
InChIKey OXWHUQQXVPKUBE-UHFFFAOYSA-O
Mol Weight 271.34 g/mol
Molecular Formula C16H19N2O2
Exact Mass 271.144653 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 3gCSZylDjYT
Name Cinchocaine-M (nor-) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-285.00]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C16H18N2O2/c1-3-5-10-20-15-11-13(16(19)17-4-2)12-8-6-7-9-14(12)18-15/h6-9,11H,2-5,10H2,1H3/p+1
InChIKey OXWHUQQXVPKUBE-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C[CH2+])C(C=1C=2C(=CC=CC2)N=C(C1)OCCCC)=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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS