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3a-Ethyl-2,6,6-trimethyl-cis-perhydroisoindol-5-one
SpectraBase Compound ID 3SiTpwQuWRJ
InChI InChI=1S/C13H23NO/c1-5-13-7-11(15)12(2,3)6-10(13)8-14(4)9-13/h10H,5-9H2,1-4H3/t10-,13+/m0/s1
InChIKey IWGSGYBRNSSWDS-GXFFZTMASA-N
Mol Weight 209.33 g/mol
Molecular Formula C13H23NO
Exact Mass 209.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUhqu6CYHdy
Name 3a-Ethyl-2,6,6-trimethyl-cis-perhydroisoindol-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23NO
InChI InChI=1S/C13H23NO/c1-5-13-7-11(15)12(2,3)6-10(13)8-14(4)9-13/h10H,5-9H2,1-4H3/t10-,13+/m0/s1
InChIKey IWGSGYBRNSSWDS-GXFFZTMASA-N
Molecular Weight 209.333 g/mol
SMILES [C@@]12([C@@](CC(C(C2)=O)(C)C)(CN(C1)C)[H])CC
SPLASH splash10-0a4i-9220000000-91a2a715acc8cd74aef4
Source of Spectrum B-29-1973-0
Synonyms (3aS,7aR)-3a-ethyl-2,6,6-trimethyloctahydro-5H-isoindol-5-one
Wiley ID 1208283