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1-Nitronaphthalene
SpectraBase Compound ID A8Jm3Zct5tg
InChI InChI=1S/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChIKey RJKGJBPXVHTNJL-UHFFFAOYSA-N
Mol Weight 173.17 g/mol
Molecular Formula C10H7NO2
Exact Mass 173.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNpsTcIAF4m
Name 1-Nitro-naphtalene
CAS Registry Number 86-57-7
Classification Chemical
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 173.047678467 u
Formula C10H7NO2
InChI InChI=1S/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChIKey RJKGJBPXVHTNJL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 173.171 g/mol
SMILES c1(cccc2ccccc12)[N+]([O-])=O
SPLASH splash10-00or-4900000000-f99dd134b462be3193d5
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_9195