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1H-Isoindol-1-one, 3-ethoxy-2,3-dihydro-2-(1-methyl-2-propenyl)-, (R*,S*)-
SpectraBase Compound ID 1Pj0HGxsSt0
InChI InChI=1S/C14H17NO2/c1-4-10(3)15-13(16)11-8-6-7-9-12(11)14(15)17-5-2/h4,6-10,14H,1,5H2,2-3H3/t10-,14+/m0/s1
InChIKey IONMKIAGCNUAMW-IINYFYTJSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33Ci6BE9OIr
Name 1H-Isoindol-1-one, 3-ethoxy-2,3-dihydro-2-(1-methyl-2-propenyl)-, (R*,S*)-
CAS Registry Number 57754-69-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-4-10(3)15-13(16)11-8-6-7-9-12(11)14(15)17-5-2/h4,6-10,14H,1,5H2,2-3H3/t10-,14+/m0/s1
InChIKey IONMKIAGCNUAMW-IINYFYTJSA-N
Molecular Weight 231.295 g/mol
SMILES C1(N([C@@](c2ccccc12)(OCC)[H])[C@](C=C)(C)[H])=O
SPLASH splash10-0f8i-1930000000-8d6637b24898529b4455
Source of Spectrum C-97-7294-0
Synonyms (3R)-3-ethoxy-2-[(1S)-1-methyl-2-propenyl]-2,3-dihydro-1H-isoindol-1-one 2,3-Dihydro-3-ethoxy-2-(3'-(2'-methylpropenyl))-isoindolone
Wiley ID 1232866