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Di-(1R,2S,5R)-(-)-menthyl (E)-1-(1'-chloro-1'-phenyl)prop-2'-yl-1,2-diazanedicarboxylate
SpectraBase Compound ID IwRi6CrgJFi
InChI InChI=1S/C31H49ClN2O4/c1-19(2)25-15-13-21(5)17-27(25)37-30(35)33-34(23(7)29(32)24-11-9-8-10-12-24)31(36)38-28-18-22(6)14-16-26(28)20(3)4/h8-12,19-23,25-29H,13-18H2,1-7H3,(H,33,35)/t21-,22-,23?,25+,26+,27-,28-,29?/m1/s1
InChIKey CZZPWDQTZIMPFI-VMCFCHFQSA-N
Mol Weight 549.2 g/mol
Molecular Formula C31H49ClN2O4
Exact Mass 548.338086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9d26dItSYWv
Name Di-(1R,2S,5R)-(-)-menthyl (E)-1-(1'-chloro-1'-phenyl)prop-2'-yl-1,2-diazanedicarboxylate
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Formula C31H49ClN2O4
InChI InChI=1S/C31H49ClN2O4/c1-19(2)25-15-13-21(5)17-27(25)37-30(35)33-34(23(7)29(32)24-11-9-8-10-12-24)31(36)38-28-18-22(6)14-16-26(28)20(3)4/h8-12,19-23,25-29H,13-18H2,1-7H3,(H,33,35)/t21-,22-,23?,25+,26+,27-,28-,29?/m1/s1
InChIKey CZZPWDQTZIMPFI-VMCFCHFQSA-N
Molecular Weight 549.196 g/mol
SMILES N(C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)N(C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)C(C(c1ccccc1)Cl)C
SPLASH splash10-0uei-0900060000-f664910325b7f7414103
Source of Spectrum QC-7-2013-15
Synonyms bis[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]1-(2-chloro-1-methyl-2-phenylethyl)-1,2-hydrazinedicarboxylate Di-(-)-menthyl (E)-1-(1'-chloro-1'-phenyl)prop-2'-yl-1,2-diazanedicarboxylate
Wiley ID 869346