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Methyl syn-4-ethyl-7-ethylidene-1,1,2,3,3,6-hexamethyl-2,3,4.alpha.,5.alpha.,6.beta.,7-hexahydro-1H-isoindole-5-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl syn-4-ethyl-7-ethylidene-1,1,2,3,3,6-hexamethyl-2,3,4.alpha.,5.alpha.,6.beta.,7-hexahydro-1H-isoindole-5-carboxylate
SpectraBase Compound ID Acy2oLAN0kU
InChI InChI=1S/C20H33NO2/c1-10-13-12(3)15(18(22)23-9)14(11-2)17-16(13)19(4,5)21(8)20(17,6)7/h10,12,14-15H,11H2,1-9H3/b13-10+/t12-,14+,15+/m0/s1
InChIKey WPYCTMGYZYHBAK-UMNHDCKHSA-N
Mol Weight 319.5 g/mol
Molecular Formula C20H33NO2
Exact Mass 319.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQKHNjrsYvo
Name Methyl syn-4-ethyl-7-ethylidene-1,1,2,3,3,6-hexamethyl-2,3,4.alpha.,5.alpha.,6.beta.,7-hexahydro-1H-isoindole-5-carboxylate
Alternate Name(s) Methyl (4R,5R,6R,7E)-4-ethyl-7-ethylidene-1,1,2,3,3,6-hexamethyl-2,3,4,5,6,7-hexahydro-1H-isoindole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33NO2
InChI InChI=1S/C20H33NO2/c1-10-13-12(3)15(18(22)23-9)14(11-2)17-16(13)19(4,5)21(8)20(17,6)7/h10,12,14-15H,11H2,1-9H3/b13-10+/t12-,14+,15+/m0/s1
InChIKey WPYCTMGYZYHBAK-UMNHDCKHSA-N
Molecular Weight 319.489 g/mol
SMILES C12=C(C(C)(C)N(C2(C)C)C)[C@@](CC)([H])[C@@]([C@](\C1=C\C)(C)[H])(C(=O)OC)[H]
SPLASH splash10-0pb9-4549000000-0802b5e3d666417a807d
Source of Spectrum KB-1992-1413-8
Wiley ID 775692