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Benzene, 1,3-dibromo-2,4,6-trimethyl-5-nitro-
SpectraBase Compound ID C9NviwJ2Znq
InChI InChI=1S/C9H9Br2NO2/c1-4-7(10)5(2)9(12(13)14)6(3)8(4)11/h1-3H3
InChIKey XCBBCEXYECFCJL-UHFFFAOYSA-N
Mol Weight 322.98 g/mol
Molecular Formula C9H9Br2NO2
Exact Mass 320.900005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yTJZsogBHR
Name Benzene, 1,3-dibromo-2,4,6-trimethyl-5-nitro-
Alternate Name(s) 1,3-Dibromo-2,4,6-trimethyl-5-nitrobenzene 1,3-bis(bromanyl)-2,4,6-trimethyl-5-nitro-benzene
CAS Registry Number 40572-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9Br2NO2
InChI InChI=1S/C9H9Br2NO2/c1-4-7(10)5(2)9(12(13)14)6(3)8(4)11/h1-3H3
InChIKey XCBBCEXYECFCJL-UHFFFAOYSA-N
Molecular Weight 322.984 g/mol
SMILES Cc1c(c(C)c(c(C)c1Br)Br)N(=O)=O
SPLASH splash10-066r-8925000000-4029c47bd4c1d8637f77
Source of Spectrum EP-6535-0-0
Wiley ID 1320714