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N-PARA-TOLYL-5-NITRO-4-METHYL-3A,4,5,7A-TETRAHYDRO-5,7A-EPOXYISOINDOLINE
SpectraBase Compound ID KDfLXUVL0SG
InChI InChI=1S/C16H18INO/c1-11-3-5-13(6-4-11)18-9-14-12(2)16(17)8-7-15(14,10-18)19-16/h3-8,12,14H,9-10H2,1-2H3
InChIKey JICUCUWCDIRVGT-UHFFFAOYSA-N
Mol Weight 367.23 g/mol
Molecular Formula C16H18INO
Exact Mass 367.043309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dGwcS89RI
Name N-(p-Tolyl)-4-methyl-5-iodo-3a,4,5,7a-tetrahydro-5,7a-epoxyisoindoline
Alternate Name(s) 7-iodo-6-methyl-3-(4-methylphenyl)-10-oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18INO
InChI InChI=1S/C16H18INO/c1-11-3-5-13(6-4-11)18-9-14-12(2)16(17)8-7-15(14,10-18)19-16/h3-8,12,14H,9-10H2,1-2H3
InChIKey JICUCUWCDIRVGT-UHFFFAOYSA-N
Molecular Weight 367.230 g/mol
SMILES C123C(CN(C3)c3ccc(cc3)C)C(C)C(O2)(I)C=C1
SPLASH splash10-066r-4089000000-225c7faeaf630e8069d2
Source of Spectrum Y-34-1321-15
Wiley ID 1352442