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Drofenine
SpectraBase Compound ID 7GWUXRwRc93
InChI InChI=1S/C20H31NO2/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,18-19H,3-4,6,9-10,13-16H2,1-2H3
InChIKey AGJBLWCLQCKRJP-UHFFFAOYSA-N
Mol Weight 317.47 g/mol
Molecular Formula C20H31NO2
Exact Mass 317.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEgKsQhDJql
Name Drofenine
CAS Registry Number 1679-76-1
Classification Anticholinergic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 317.235479240 u
Formula C20H31NO2
InChI InChI=1S/C20H31NO2/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,18-19H,3-4,6,9-10,13-16H2,1-2H3
InChIKey AGJBLWCLQCKRJP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 317.473 g/mol
SMILES c1ccccc1C(C(OCCN(CC)CC)=O)C1CCCCC1
SPLASH splash10-000i-9000000000-d632bf536c586fd32ad3
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_747