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1,4-Naphthalenediol, diacetate
SpectraBase Compound ID It7WEvX7v1Z
InChI InChI=1S/C14H12O4/c1-9(15)17-13-7-8-14(18-10(2)16)12-6-4-3-5-11(12)13/h3-8H,1-2H3
InChIKey SFAVMNCWIUOBCX-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C14H12O4
Exact Mass 244.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDwdFMDlVqf
Name Duloxetine-M (4-HO-1-naphthol) 2AC @
CAS Registry Number 5697-00-7
Classification Antidepressant Beta-Blocker
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 244.073558862 u
Formula C14H12O4
InChI InChI=1S/C14H12O4/c1-9(15)17-13-7-8-14(18-10(2)16)12-6-4-3-5-11(12)13/h3-8H,1-2H3
InChIKey SFAVMNCWIUOBCX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 244.246 g/mol
SMILES c12ccccc1c(ccc2OC(=O)C)OC(C)=O
SPLASH splash10-03di-1920000000-56e63a7dcb3bfc3bea23
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.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Naphthalene-M (1,4-di-HO-) 2AC Propranolol-M (4-HO-1-naphthol) 2AC
Technique GC/MS
Wiley ID MMPW6e_933