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Dipyanone
SpectraBase Compound ID Kz1Coj5ioWf
InChI InChI=1S/C23H29NO/c1-3-22(25)23(20-12-6-4-7-13-20,21-14-8-5-9-15-21)18-19(2)24-16-10-11-17-24/h4-9,12-15,19H,3,10-11,16-18H2,1-2H3
InChIKey LJIUPFDRFKFNJE-UHFFFAOYSA-N
Mol Weight 335.49 g/mol
Molecular Formula C23H29NO
Exact Mass 335.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AP0sxMGFC8x
Name Dipyanone
CAS Registry Number 60996-94-3
Classification Designer drug Opioid
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 335.224914557 u
Formula C23H29NO
InChI InChI=1S/C23H29NO/c1-3-22(25)23(20-12-6-4-7-13-20,21-14-8-5-9-15-21)18-19(2)24-16-10-11-17-24/h4-9,12-15,19H,3,10-11,16-18H2,1-2H3
InChIKey LJIUPFDRFKFNJE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 335.491 g/mol
SMILES c1c(C(c2ccccc2)(CC(N2CCCC2)C)C(=O)CC)cccc1
SPLASH splash10-052b-9500000000-965638db7a4afc1ed148
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_10890