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2-[(5-Allyl-2,2-dimethyl-1,3-dioxan-5-yl)methoxy]isoindoline-1,3-dione
SpectraBase Compound ID GzWcJkPkqH3
InChI InChI=1S/C18H21NO5/c1-4-9-18(10-22-17(2,3)23-11-18)12-24-19-15(20)13-7-5-6-8-14(13)16(19)21/h4-8H,1,9-12H2,2-3H3
InChIKey VEPSMPYUASVSPE-UHFFFAOYSA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lZ28KL74qP
Name 2-[(5-Allyl-2,2-dimethyl-1,3-dioxan-5-yl)methoxy]isoindoline-1,3-dione
Appearance Yellowish oil
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Exact Mass 331.141972775 u
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-4-9-18(10-22-17(2,3)23-11-18)12-24-19-15(20)13-7-5-6-8-14(13)16(19)21/h4-8H,1,9-12H2,2-3H3
InChIKey VEPSMPYUASVSPE-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/anie.201710895
Molecular Weight 331.368 g/mol
Quality 389
Reported Formula C18H21NO5
SMILES C1(OCC(CO1)(CON1C(C2=C(C1=O)C=CC=C2)=O)CC=C)(C)C
SPLASH splash10-07yi-9402000000-a8c2a4eb259b48048054
Source of Spectrum ACI-57-SM23-15g (DOI: 10.1002/anie.201710895)
Wiley ID 1890798