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Diethyl 1,1,2,3,3-pentamethyl-7-methylene-2,3,4,5.alpha.,6.beta.,7-hexahydro-1H-isoindole-5,6-dicarboxylate
SpectraBase Compound ID ILlsIb5mGhR
InChI InChI=1S/C20H31NO4/c1-9-24-17(22)13-11-14-16(12(3)15(13)18(23)25-10-2)20(6,7)21(8)19(14,4)5/h13,15H,3,9-11H2,1-2,4-8H3/t13-,15-/m0/s1
InChIKey AYWZXATTYYQHEL-ZFWWWQNUSA-N
Mol Weight 349.47 g/mol
Molecular Formula C20H31NO4
Exact Mass 349.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vHhWhKLlpV
Name Diethyl 1,1,2,3,3-pentamethyl-7-methylene-2,3,4,5.alpha.,6.beta.,7-hexahydro-1H-isoindole-5,6-dicarboxylate
Alternate Name(s) Diethyl (5R,6S)-1,1,2,3,3-pentamethyl-4-methylene-2,3,4,5,6,7-hexahydro-1H-isoindole-5,6-dicarboxylate
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Formula C20H31NO4
InChI InChI=1S/C20H31NO4/c1-9-24-17(22)13-11-14-16(12(3)15(13)18(23)25-10-2)20(6,7)21(8)19(14,4)5/h13,15H,3,9-11H2,1-2,4-8H3/t13-,15-/m0/s1
InChIKey AYWZXATTYYQHEL-ZFWWWQNUSA-N
Molecular Weight 349.471 g/mol
SMILES C12=C(C(C)(C)N(C2(C)C)C)C[C@@]([C@](C1=C)(C(=O)OCC)[H])(C(=O)OCC)[H]
SPLASH splash10-0019-0219000000-d198d5639e357ed7802d
Source of Spectrum KB-1992-1412-8
Wiley ID 775699