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4-[4,5-Dihydro-4(S)-trans-(methoxymethyl)-5(S)-phenyl-2-oxozolyl]-5-((R,S)-1'-[N,N'-bis(ethoxycarbonyl)hydrazino]eth-1'-yl]isoxazole

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4-[4,5-Dihydro-4(S)-trans-(methoxymethyl)-5(S)-phenyl-2-oxozolyl]-5-((R,S)-1'-[N,N'-bis(ethoxycarbonyl)hydrazino]eth-1'-yl]isoxazole
SpectraBase Compound ID 8l6QPhQwQTC
InChI InChI=1S/C28H32N4O7/c1-5-36-27(33)30-32(28(34)37-6-2)18(3)24-22(23(31-39-24)19-13-9-7-10-14-19)26-29-21(17-35-4)25(38-26)20-15-11-8-12-16-20/h7-16,18,21,25H,5-6,17H2,1-4H3,(H,30,33)/t18-,21-,25-/m0/s1
InChIKey CHGIBLLSUAEYNI-HMHJJOSWSA-N
Mol Weight 536.6 g/mol
Molecular Formula C28H32N4O7
Exact Mass 536.227099 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YWy8sRhcnj
Name 4-[4,5-Dihydro-4(S)-trans-(methoxymethyl)-5(S)-phenyl-2-oxozolyl]-5-((R,S)-1'-[N,N'-bis(ethoxycarbonyl)hydrazino]eth-1'-yl]isoxazole
Alternate Name(s) 4-[4,5-Dihydro-4(S)-trans-(methoxymethyl)-5(S)-phenyl-2-oxozolyl]-5-((R)-1'-[N,N'-bis(ethoxycarbonyl)hydrazino]eth-1'-yl]isoxazole
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Formula C28H32N4O7
InChI InChI=1S/C28H32N4O7/c1-5-36-27(33)30-32(28(34)37-6-2)18(3)24-22(23(31-39-24)19-13-9-7-10-14-19)26-29-21(17-35-4)25(38-26)20-15-11-8-12-16-20/h7-16,18,21,25H,5-6,17H2,1-4H3,(H,30,33)/t18-,21-,25-/m0/s1
InChIKey CHGIBLLSUAEYNI-HMHJJOSWSA-N
Molecular Weight 536.585 g/mol
SMILES N(N([C@](c1c(C2=N[C@@](COC)([C@@](O2)(c2ccccc2)[H])[H])c(no1)-c1ccccc1)(C)[H])C(=O)OCC)C(=O)OCC
SPLASH splash10-03di-4609100000-10e9797968797ab3aa93
Source of Spectrum J-57-6276-(Table 1, Entry 10)
Wiley ID 1404056