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Ethyl 1-Cyano-14-oxo-cis-bicyclo[10.3.0]pentadecane-13-carboxylate
SpectraBase Compound ID JHqZJvkxE69
InChI InChI=1S/C19H29NO3/c1-2-23-18(22)17-15-11-9-7-5-3-4-6-8-10-12-19(15,14-20)13-16(17)21/h15,17H,2-13H2,1H3/t15-,17?,19+/m0/s1
InChIKey JVZUVIUXRNOCCT-APROBQCTSA-N
Mol Weight 319.45 g/mol
Molecular Formula C19H29NO3
Exact Mass 319.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjT5AE8RvtR
Name Ethyl 1-Cyano-14-oxo-cis-bicyclo[10.3.0]pentadecane-13-carboxylate
Alternate Name(s) Ethyl (3aS,13aS)-3a-cyano-2-oxotetradecahydro-1H-cyclopenta[a]cyclododecene-1-carboxylate
CAS Registry Number 113541-15-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29NO3
InChI InChI=1S/C19H29NO3/c1-2-23-18(22)17-15-11-9-7-5-3-4-6-8-10-12-19(15,14-20)13-16(17)21/h15,17H,2-13H2,1H3/t15-,17?,19+/m0/s1
InChIKey JVZUVIUXRNOCCT-APROBQCTSA-N
Molecular Weight 319.445 g/mol
SMILES C1(C(C[C@@]2([C@]1(CCCCCCCCCC2)[H])C#N)=O)C(=O)OCC
SPLASH splash10-0aou-9520000000-0b2be1fd8f478548779f
Source of Spectrum H-70-1397-6
Wiley ID 1319464