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4-Heptyl-2-methyl-6-thiophen-2-yl-3a,4,7,7a-tetrahydroisoindol-1,3-dione
SpectraBase Compound ID C7tUqYiip9G
InChI InChI=1S/C20H27NO2S/c1-3-4-5-6-7-9-14-12-15(17-10-8-11-24-17)13-16-18(14)20(23)21(2)19(16)22/h8,10-12,14,16,18H,3-7,9,13H2,1-2H3
InChIKey WYDMGAKPHIYNEV-UHFFFAOYSA-N
Mol Weight 345.5 g/mol
Molecular Formula C20H27NO2S
Exact Mass 345.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kUYHjB3iEY
Name 4-Heptyl-2-methyl-6-thiophen-2-yl-3a,4,7,7a-tetrahydroisoindol-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO2S
InChI InChI=1S/C20H27NO2S/c1-3-4-5-6-7-9-14-12-15(17-10-8-11-24-17)13-16-18(14)20(23)21(2)19(16)22/h8,10-12,14,16,18H,3-7,9,13H2,1-2H3
InChIKey WYDMGAKPHIYNEV-UHFFFAOYSA-N
Molecular Weight 345.501 g/mol
SMILES C1(N(C(C2C(C=C(CC12)c1cccs1)CCCCCCC)=O)C)=O
SPLASH splash10-01ot-0793000000-2b99094e579f5849d28b
Source of Spectrum F-57-10353-36
Synonyms 4-Heptyl-2-methyl-6-(2-thienyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Wiley ID 1626857