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Rl,trans-2, trans-3a, trans-7a, Ethyl 2-Trichloroacetylamino-octahydro-1H-indene-1-carboxylate
SpectraBase Compound ID 8oDRA94P0kr
InChI InChI=1S/C14H20Cl3NO3/c1-2-21-12(19)11-9-6-4-3-5-8(9)7-10(11)18-13(20)14(15,16)17/h8-11H,2-7H2,1H3,(H,18,20)/t8-,9-,10+,11+/m1/s1
InChIKey PCWXJMNPLVXXHO-ZNSHCXBVSA-N
Mol Weight 356.68 g/mol
Molecular Formula C14H20Cl3NO3
Exact Mass 355.050877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSwSLZKRuTn
Name Rl,trans-2, trans-3a, trans-7a, Ethyl 2-Trichloroacetylamino-octahydro-1H-indene-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H20Cl3NO3
InChI InChI=1S/C14H20Cl3NO3/c1-2-21-12(19)11-9-6-4-3-5-8(9)7-10(11)18-13(20)14(15,16)17/h8-11H,2-7H2,1H3,(H,18,20)/t8-,9-,10+,11+/m1/s1
InChIKey PCWXJMNPLVXXHO-ZNSHCXBVSA-N
Molecular Weight 356.677 g/mol
SMILES N([C@]1(C[C@]2(CCCC[C@]2([C@@]1(C(OCC)=O)[H])[H])[H])[H])C(=O)C(Cl)(Cl)Cl
SPLASH splash10-0002-9000000000-589f57f0f9f8bc5d25b0
Source of Spectrum CAJ-5-1117-16h
Synonyms (1S,2S,3aR,7aR)-ethyl 2-(2,2,2-trichloroacetamido)octahydro-1H-indene-1-carboxylate
Wiley ID 1774635