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2-[(1-Allylcyclohexyl)methoxy]isoindoline-1,3-dione
SpectraBase Compound ID K7CyLC9XJg9
InChI InChI=1S/C18H21NO3/c1-2-10-18(11-6-3-7-12-18)13-22-19-16(20)14-8-4-5-9-15(14)17(19)21/h2,4-5,8-9H,1,3,6-7,10-13H2
InChIKey IKHQZSYHHMOVMB-UHFFFAOYSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5u4afYyksdj
Name 2-[(1-Allylcyclohexyl)methoxy]isoindoline-1,3-dione
Appearance White solid
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Exact Mass 299.152143537 u
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-2-10-18(11-6-3-7-12-18)13-22-19-16(20)14-8-4-5-9-15(14)17(19)21/h2,4-5,8-9H,1,3,6-7,10-13H2
InChIKey IKHQZSYHHMOVMB-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/anie.201710895
Quality 137
Reported Formula C18H21NO3
SMILES C1CCCC(C1)(CON1C(C2=C(C1=O)C=CC=C2)=O)CC=C
SPLASH splash10-0012-9200000000-e32f169a21c444745b84
Source of Spectrum ACI-57-SM11-15c (DOI: 10.1002/anie.201710895)
Wiley ID 1890795