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Benzene, 1-nitro-3-propyl-
SpectraBase Compound ID Kq8kutBfHXY
InChI InChI=1S/C9H11NO2/c1-2-4-8-5-3-6-9(7-8)10(11)12/h3,5-7H,2,4H2,1H3
InChIKey DFYMEQJBQLOZGW-UHFFFAOYSA-N
Mol Weight 165.19 g/mol
Molecular Formula C9H11NO2
Exact Mass 165.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ac45JUNWj1v
Name Benzene, 1-nitro-3-propyl-
Alternate Name(s) 1-Nitro-3-propylbenzene
CAS Registry Number 73585-59-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO2
InChI InChI=1S/C9H11NO2/c1-2-4-8-5-3-6-9(7-8)10(11)12/h3,5-7H,2,4H2,1H3
InChIKey DFYMEQJBQLOZGW-UHFFFAOYSA-N
Molecular Weight 165.192 g/mol
SMILES CCCc1cccc(c1)N(=O)=O
SPLASH splash10-000f-9700000000-710a0ee32f35bfdba83b
Source of Spectrum O-14-449-2
Wiley ID 1161351