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trans-β-Methyl-β-nitrostyrene
SpectraBase Compound ID LLgc8D40mTI
InChI InChI=1S/C9H9NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-7H,1H3/b8-7+
InChIKey WGSVFWFSJDAYBM-BQYQJAHWSA-N
Mol Weight 163.18 g/mol
Molecular Formula C9H9NO2
Exact Mass 163.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tOBUyFGfei
Name Amfetamine intermediate @
CAS Registry Number 705-60-2
Classification Stimulant Chemical
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 163.063328532 u
Formula C9H9NO2
InChI InChI=1S/C9H9NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-7H,1H3/b8-7+
InChIKey WGSVFWFSJDAYBM-BQYQJAHWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 163.176 g/mol
SMILES c1ccccc1\C=C/(C)N(=O)=O
SPLASH splash10-014i-9600000000-59690d0c37d1e10872fa
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
Synonyms Methylnitrostyrene
Technique GC/MS
Wiley ID MMPW6e_2839