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(1R,2S,5R)-5-Methyl-2-(1'-methyl-1'-phenylethyl)cyclohexyl 8-iodoocta-2,7-dienoate
SpectraBase Compound ID H9ahxbSrTJa
InChI InChI=1S/C24H33IO2/c1-19-15-16-21(24(2,3)20-12-8-7-9-13-20)22(18-19)27-23(26)14-10-5-4-6-11-17-25/h7-14,17,19,21-22H,4-6,15-16,18H2,1-3H3/b14-10+,17-11-/t19-,21-,22-/m1/s1
InChIKey ZLZHYANMKUOVRM-UFSWDGLYSA-N
Mol Weight 480.4 g/mol
Molecular Formula C24H33IO2
Exact Mass 480.152525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xo5BXRqSCB
Name (1R,2S,5R)-5-Methyl-2-(1'-methyl-1'-phenylethyl)cyclohexyl 8-iodoocta-2,7-dienoate
Alternate Name(s) (1R,2S,5R)-5-methyl-2-(1-methyl-1-phenylethyl)cyclohexyl (2E,7Z)-8-iodo-2,7-octadienoate 5-Methyl-2-(1'-methyl-1'-phenylethyl)cyclohexyl 8-iodoocta-2,7-dienoate (2E,7Z)-8-iodoocta-2,7-dienoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2E,7Z)-8-iodoocta-2,7-dienoate [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (2E,7Z)-8-iodoocta-2,7-dienoate [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2E,7Z)-8-iodanylocta-2,7-dienoate
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Formula C24H33IO2
InChI InChI=1S/C24H33IO2/c1-19-15-16-21(24(2,3)20-12-8-7-9-13-20)22(18-19)27-23(26)14-10-5-4-6-11-17-25/h7-14,17,19,21-22H,4-6,15-16,18H2,1-3H3/b14-10+,17-11-/t19-,21-,22-/m1/s1
InChIKey ZLZHYANMKUOVRM-UFSWDGLYSA-N
Molecular Weight 480.430 g/mol
SMILES [C@]1([C@](OC(\C=C\CCC\C=C/I)=O)(C[C@@](CC1)(C)[H])[H])(C(c1ccccc1)(C)C)[H]
SPLASH splash10-014i-3910000000-ea91d2b6ca7dc90ade15
Source of Spectrum U1-1999-1932-26
Wiley ID 753304