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Methyl ester of (1.alpha.,2.alpha.,3.alpha.)-1-cyano-2-ethyl-2,3-diemthyl cyclobutanecarboxylic acid
SpectraBase Compound ID 4e4qfuqxYO5
InChI InChI=1S/C11H17NO2/c1-5-10(3)8(2)6-11(10,7-12)9(13)14-4/h8H,5-6H2,1-4H3/t8-,10+,11+/m1/s1
InChIKey NTWJRMNUPNJEGY-MIMYLULJSA-N
Mol Weight 195.26 g/mol
Molecular Formula C11H17NO2
Exact Mass 195.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IM8XD61pm6q
Name Methyl ester of (1.alpha.,2.alpha.,3.alpha.)-1-cyano-2-ethyl-2,3-diemthyl cyclobutanecarboxylic acid
CAS Registry Number 77257-25-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO2
InChI InChI=1S/C11H17NO2/c1-5-10(3)8(2)6-11(10,7-12)9(13)14-4/h8H,5-6H2,1-4H3/t8-,10+,11+/m1/s1
InChIKey NTWJRMNUPNJEGY-MIMYLULJSA-N
Molecular Weight 195.262 g/mol
SMILES [C@@]1([C@](CC)(C)[C@@](C1)(C)[H])(C(=O)OC)C#N
SPLASH splash10-001i-9200000000-fd957bd2aaa6bc25d127
Source of Spectrum J-46-2566-0
Synonyms Methyl (1S,2S,3R)-1-cyano-2-ethyl-2,3-dimethylcyclobutanecarboxylate
Wiley ID 1192079