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Ethyl 1-cyano-8-hydroxybicyclo[6.4.0]dodecane-9-carboxylate
SpectraBase Compound ID FMQjLkSeTrr
InChI InChI=1S/C16H25NO3/c1-2-20-14(18)13-8-7-10-15(12-17)9-5-3-4-6-11-16(13,15)19/h13,19H,2-11H2,1H3
InChIKey KSZWMBKRPKHRDA-UHFFFAOYSA-N
Mol Weight 279.38 g/mol
Molecular Formula C16H25NO3
Exact Mass 279.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsiVew2Hzr4
Name Ethyl 1-cyano-8-hydroxybicyclo[6.4.0]dodecane-9-carboxylate
CAS Registry Number 104890-86-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO3
InChI InChI=1S/C16H25NO3/c1-2-20-14(18)13-8-7-10-15(12-17)9-5-3-4-6-11-16(13,15)19/h13,19H,2-11H2,1H3
InChIKey KSZWMBKRPKHRDA-UHFFFAOYSA-N
Molecular Weight 279.380 g/mol
SMILES OC12C(C(=O)OCC)CCCC2(C#N)CCCCCC1
SPLASH splash10-0ac7-9400000000-557c9912b5817d05dc0d
Source of Spectrum H-68-1993-20
Synonyms Ethyl 4a-cyano-10a-hydroxydodecahydrobenzo[a]cyclooctene-1-carboxylate
Wiley ID 1283061