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2H-Isoindole-2-acetic acid, .alpha.-bromo-.alpha.-cyano-1,3-dihydro-1,3-dioxo-, 1,1-dimethylethyl ester, (.+-.)-
SpectraBase Compound ID 6lxC3WAKigl
InChI InChI=1S/C15H13BrN2O4/c1-14(2,3)22-13(21)15(16,8-17)18-11(19)9-6-4-5-7-10(9)12(18)20/h4-7H,1-3H3
InChIKey QVMAXEUHVANSDU-UHFFFAOYSA-N
Mol Weight 365.18 g/mol
Molecular Formula C15H13BrN2O4
Exact Mass 364.00587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfTfH1v3J0D
Name 2H-Isoindole-2-acetic acid, .alpha.-bromo-.alpha.-cyano-1,3-dihydro-1,3-dioxo-, 1,1-dimethylethyl ester, (.+-.)-
CAS Registry Number 122123-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13BrN2O4
InChI InChI=1S/C15H13BrN2O4/c1-14(2,3)22-13(21)15(16,8-17)18-11(19)9-6-4-5-7-10(9)12(18)20/h4-7H,1-3H3
InChIKey QVMAXEUHVANSDU-UHFFFAOYSA-N
Molecular Weight 365.183 g/mol
SMILES C(N1C(c2ccccc2C1=O)=O)(C(OC(C)(C)C)=O)(C#N)Br
SPLASH splash10-0a4i-9510000000-08a4f8604838a4342188
Source of Spectrum F-46-5270-14
Synonyms t-Butyl 2-bromo-2-cyano-2-phthalimido-ethanoate tert-Butyl bromo(cyano)(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Wiley ID 1350524