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Cyclopentanecarboxylic acid, 3-cyano-1,2,2-trimethyl-, ethyl ester, cis-
SpectraBase Compound ID LZk6JItkkaO
InChI InChI=1S/C12H19NO2/c1-5-15-10(14)12(4)7-6-9(8-13)11(12,2)3/h9H,5-7H2,1-4H3/t9-,12+/m1/s1
InChIKey AXYIADQAIZHKQV-SKDRFNHKSA-N
Mol Weight 209.29 g/mol
Molecular Formula C12H19NO2
Exact Mass 209.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LYkw2GMTjb
Name Cyclopentanecarboxylic acid, 3-cyano-1,2,2-trimethyl-, ethyl ester, cis-
Alternate Name(s) Ethyl (1R,3S)-3-cyano-1,2,2-trimethylcyclopentanecarboxylate Ethyl 3-cyano-1,2,2-trimethylcyclopentane-1-carboxylate
CAS Registry Number 73228-80-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO2
InChI InChI=1S/C12H19NO2/c1-5-15-10(14)12(4)7-6-9(8-13)11(12,2)3/h9H,5-7H2,1-4H3/t9-,12+/m1/s1
InChIKey AXYIADQAIZHKQV-SKDRFNHKSA-N
Molecular Weight 209.289 g/mol
SMILES [C@]1(C([C@@](C#N)(CC1)[H])(C)C)(C(=O)OCC)C
SPLASH splash10-000i-3900000000-c21b00f62d22309e4f3b
Source of Spectrum F-35-1137-0
Wiley ID 1208173