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1-(nitromethyl)pent-4-enylbenzene
SpectraBase Compound ID CDuRdTaAo15
InChI InChI=1S/C12H15NO2/c1-2-3-7-12(10-13(14)15)11-8-5-4-6-9-11/h2,4-6,8-9,12H,1,3,7,10H2
InChIKey QYARYTAKMVZXIX-UHFFFAOYSA-N
Mol Weight 205.26 g/mol
Molecular Formula C12H15NO2
Exact Mass 205.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7kiNADbZxXL
Name 1-(nitromethyl)pent-4-enylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO2
InChI InChI=1S/C12H15NO2/c1-2-3-7-12(10-13(14)15)11-8-5-4-6-9-11/h2,4-6,8-9,12H,1,3,7,10H2
InChIKey QYARYTAKMVZXIX-UHFFFAOYSA-N
Molecular Weight 205.257 g/mol
SMILES C(N(=O)=O)C(c1ccccc1)CCC=C
SPLASH splash10-0a4i-0900000000-ead78d94cbbcb8f0a74e
Source of Spectrum J-62-491-4
Synonyms 1-Nitrohex-5-en-2-ylbenzene
Wiley ID 1203480