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N-[2,4-Dichloro-4-(1,1-dimethylprop-2-en-1-yl)-5,5-dimethoxy-3-oxocyclopent-1-en-1-yl]-D-leucine methyl ester
SpectraBase Compound ID A9sNLUlJBFQ
InChI InChI=1S/C19H29Cl2NO5/c1-9-17(4,5)18(21)15(23)13(20)14(19(18,26-7)27-8)22-12(10-11(2)3)16(24)25-6/h9,11-12,22H,1,10H2,2-8H3/t12-,18?/m1/s1
InChIKey FGRHZTOWDKFCMJ-GKOGFXNCSA-N
Mol Weight 422.35 g/mol
Molecular Formula C19H29Cl2NO5
Exact Mass 421.142278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19npOcNkfZ5
Name N-[2,4-Dichloro-4-(1,1-dimethylprop-2-en-1-yl)-5,5-dimethoxy-3-oxocyclopent-1-en-1-yl]-D-leucine methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C19H29Cl2NO5
InChI InChI=1S/C19H29Cl2NO5/c1-9-17(4,5)18(21)15(23)13(20)14(19(18,26-7)27-8)22-12(10-11(2)3)16(24)25-6/h9,11-12,22H,1,10H2,2-8H3/t12-,18?/m1/s1
InChIKey FGRHZTOWDKFCMJ-GKOGFXNCSA-N
Molecular Weight 422.349 g/mol
SMILES N(C=1C(C(C(C=C)(C)C)(Cl)C(C1Cl)=O)(OC)OC)[C@@](C(=O)OC)(CC(C)C)[H]
SPLASH splash10-00di-0000900000-c200ee24671211a7d342
Source of Spectrum O1-47-369-10
Wiley ID 1669666