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(1-NITROMETHYL-PROPYL)-BENZENE
SpectraBase Compound ID HDwONvor5RK
InChI InChI=1S/C10H13NO2/c1-2-9(8-11(12)13)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
InChIKey DAAVBVQRJJEIOT-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nqtRYx01Rf
Name 2-Phenyl-1-nitrobutane
Alternate Name(s) Benzene, [1-(nitromethyl)propyl]-, (R)- 1-Nitro-2-phenylbutane [1-(Nitromethyl)propyl]benzene 1-Nitrobutan-2-ylbenzene
CAS Registry Number 119880-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-2-9(8-11(12)13)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
InChIKey DAAVBVQRJJEIOT-UHFFFAOYSA-N
Molecular Weight 179.219 g/mol
SMILES C(N(=O)=O)C(c1ccccc1)CC
SPLASH splash10-001l-9800000000-2312ccee2096f246770e
Source of Spectrum J-54-1804-2
Wiley ID 1175289