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5-Bromo-1,1,3,3-tetramethyl-6-nitroisoindoline

View entire compound with spectra: 1 MS (GC)

5-Bromo-1,1,3,3-tetramethyl-6-nitroisoindoline
SpectraBase Compound ID 3fUQg1z0Yk1
InChI InChI=1S/C12H15BrN2O2/c1-11(2)7-5-9(13)10(15(16)17)6-8(7)12(3,4)14-11/h5-6,14H,1-4H3
InChIKey OYJSTSHZZXUTBO-UHFFFAOYSA-N
Mol Weight 299.17 g/mol
Molecular Formula C12H15BrN2O2
Exact Mass 298.031691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rBhegeciW
Name 5-Bromo-1,1,3,3-tetramethyl-6-nitroisoindoline
Alternate Name(s) 5-Bromo-1,1,3,3-tetramethyl-6-nitro-2H-isoindole 5-Bromanyl-1,1,3,3-tetramethyl-6-nitro-2H-isoindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15BrN2O2
InChI InChI=1S/C12H15BrN2O2/c1-11(2)7-5-9(13)10(15(16)17)6-8(7)12(3,4)14-11/h5-6,14H,1-4H3
InChIKey OYJSTSHZZXUTBO-UHFFFAOYSA-N
Molecular Weight 299.168 g/mol
SMILES N1C(c2cc(c(cc2C1(C)C)N(=O)=O)Br)(C)C
SPLASH splash10-0019-0390000000-b50e2634dde147dc873f
Source of Spectrum U1-2009-1913-44
Wiley ID 1662697