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2-[(2,2-Dimethyl-4-methylenehexyl)oxy]isoindoline-1,3-dione
SpectraBase Compound ID Gq6fLUkGMR6
InChI InChI=1S/C17H21NO3/c1-5-12(2)10-17(3,4)11-21-18-15(19)13-8-6-7-9-14(13)16(18)20/h6-9H,2,5,10-11H2,1,3-4H3
InChIKey HUSHYSZWYFWFLA-UHFFFAOYSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XN3h7G75Q7
Name 2-[(2,2-Dimethyl-4-methylenehexyl)oxy]isoindoline-1,3-dione
Appearance Yellowish oil
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Exact Mass 287.152143537 u
Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-5-12(2)10-17(3,4)11-21-18-15(19)13-8-6-7-9-14(13)16(18)20/h6-9H,2,5,10-11H2,1,3-4H3
InChIKey HUSHYSZWYFWFLA-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/anie.201710895
Quality 249
Reported Formula C17H21NO3
SMILES C(C(CC(=C)CC)(C)C)ON1C(C=2C=CC=CC2C1=O)=O
SPLASH splash10-066r-9300000000-b9aaf6daf9324ecb06b9
Source of Spectrum ACI-57-SM35-15l (DOI: 10.1002/anie.201710895)
Wiley ID 1890802