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Cyclopropanecarboxylic acid, 2,2,3-trimethyl-1-(4-nitrophenyl)-, cyanomethyl ester, cis-(.+-.)-
SpectraBase Compound ID 8Idn9x4VMRr
InChI InChI=1S/C15H16N2O4/c1-10-14(2,3)15(10,13(18)21-9-8-16)11-4-6-12(7-5-11)17(19)20/h4-7,10H,9H2,1-3H3/t10-,15-/m1/s1
InChIKey SZFILCKEZZBECH-MEBBXXQBSA-N
Mol Weight 288.3 g/mol
Molecular Formula C15H16N2O4
Exact Mass 288.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIPTzh1GgXW
Name Cyclopropanecarboxylic acid, 2,2,3-trimethyl-1-(4-nitrophenyl)-, cyanomethyl ester, cis-(.+-.)-
CAS Registry Number 129919-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N2O4
InChI InChI=1S/C15H16N2O4/c1-10-14(2,3)15(10,13(18)21-9-8-16)11-4-6-12(7-5-11)17(19)20/h4-7,10H,9H2,1-3H3/t10-,15-/m1/s1
InChIKey SZFILCKEZZBECH-MEBBXXQBSA-N
Molecular Weight 288.303 g/mol
SMILES [C@]1(C(C)(C)[C@]1(C)[H])(C(=O)OCC#N)c1ccc(N(=O)=O)cc1
SPLASH splash10-01c1-6950000000-9c63d16451b54761667a
Source of Spectrum C-112-7701-4
Synonyms cyanomethyl (1R,3R)-2,2,3-trimethyl-1-(4-nitrophenyl)cyclopropanecarboxylate syn-1,1,2-trimethyl-3-(cyano-methoxy-carbonyl)-3-(p-nitrophenyl)-cyclopropane
Wiley ID 1291590