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1-nitro-4-(prop-1-yn-1-yl)benzene
SpectraBase Compound ID EkFRLqrx0Kh
InChI InChI=1S/C9H7NO2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,1H3
InChIKey WZXVLUCWGSZORJ-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DusJDK1Vp0x
Name 1-nitro-4-(prop-1-yn-1-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,1H3
InChIKey WZXVLUCWGSZORJ-UHFFFAOYSA-N
Instrument Name QP 2010
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6328
Molecular Weight 161.160 g/mol
SMILES c1([N+](=O)[O-])ccc(cc1)C#CC
SPLASH splash10-03di-5900000000-63f0329b442ecace22fd
Source of Spectrum AOC-35-SM33-3n
Wiley ID 1864300