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(E)-Trimethyl 2-cyanocyclopropane-3-(3-bromophenyl)-1,1,2-tricarboxylate
SpectraBase Compound ID FtvVxFGB1ef
InChI InChI=1S/C16H14BrNO6/c1-22-12(19)15(8-18)11(9-5-4-6-10(17)7-9)16(15,13(20)23-2)14(21)24-3/h4-7,11H,1-3H3/t11-,15+/m0/s1
InChIKey WUZSTVVMWAINIV-XHDPSFHLSA-N
Mol Weight 396.19 g/mol
Molecular Formula C16H14BrNO6
Exact Mass 395.00045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9m324IpvEH
Name (E)-Trimethyl 2-cyanocyclopropane-3-(3-bromophenyl)-1,1,2-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14BrNO6
InChI InChI=1S/C16H14BrNO6/c1-22-12(19)15(8-18)11(9-5-4-6-10(17)7-9)16(15,13(20)23-2)14(21)24-3/h4-7,11H,1-3H3/t11-,15+/m0/s1
InChIKey WUZSTVVMWAINIV-XHDPSFHLSA-N
Molecular Weight 396.193 g/mol
SMILES C1([C@](C(=O)OC)(C#N)[C@@]1(c1cc(Br)ccc1)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-052r-4149000000-b490691aafacd1017408
Source of Spectrum F-62-3995-3
Wiley ID 1633023