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Methyl 3-(1'-nitrocyclohexyl)-2-phthalomidopropanoate
SpectraBase Compound ID ClFtGtiP9oG
InChI InChI=1S/C18H20N2O6/c1-26-17(23)14(11-18(20(24)25)9-5-2-6-10-18)19-15(21)12-7-3-4-8-13(12)16(19)22/h3-4,7-8,14H,2,5-6,9-11H2,1H3/t14-/m0/s1
InChIKey BEDQUBBNAGQSFZ-AWEZNQCLSA-N
Mol Weight 360.37 g/mol
Molecular Formula C18H20N2O6
Exact Mass 360.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LK5whpMCVSb
Name Methyl 3-(1'-nitrocyclohexyl)-2-phthalomidopropanoate
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Formula C18H20N2O6
InChI InChI=1S/C18H20N2O6/c1-26-17(23)14(11-18(20(24)25)9-5-2-6-10-18)19-15(21)12-7-3-4-8-13(12)16(19)22/h3-4,7-8,14H,2,5-6,9-11H2,1H3/t14-/m0/s1
InChIKey BEDQUBBNAGQSFZ-AWEZNQCLSA-N
Molecular Weight 360.366 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@@](CC1(N(=O)=O)CCCCC1)(C(=O)OC)[H])=O
SPLASH splash10-0udi-0096000000-18030713b9fc018dee9e
Source of Spectrum KC-0-1118-14
Synonyms (S)-2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-(1-nitro-cyclohexyl)-propionic acid methyl ester Methyl 3-(1-nitrocyclohexyl)-2-phthalomidopropanoate
Wiley ID 824669