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8a-(2-iodobenzyl)-3,4,7,8-tetrahydro-2H-naphthalene-1,6-quinone
SpectraBase Compound ID BsOalia8E2n
InChI InChI=1S/C17H17IO2/c18-15-6-2-1-4-12(15)11-17-9-8-14(19)10-13(17)5-3-7-16(17)20/h1-2,4,6,10H,3,5,7-9,11H2
InChIKey PUEFLWGDFCHFDB-UHFFFAOYSA-N
Mol Weight 380.23 g/mol
Molecular Formula C17H17IO2
Exact Mass 380.027325 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfKshSqR7Vt
Name 8a-(2-iodobenzyl)-3,4,7,8-tetrahydro-2H-naphthalene-1,6-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17IO2
InChI InChI=1S/C17H17IO2/c18-15-6-2-1-4-12(15)11-17-9-8-14(19)10-13(17)5-3-7-16(17)20/h1-2,4,6,10H,3,5,7-9,11H2
InChIKey PUEFLWGDFCHFDB-UHFFFAOYSA-N
Molecular Weight 380.225 g/mol
SMILES C12(C(=CC(CC2)=O)CCCC1=O)Cc1c(I)cccc1
SPLASH splash10-0aor-9020000000-60b3a22f3ae334a90c06
Source of Spectrum SK-24-290-1
Synonyms 8a-[(2-iodanylphenyl)methyl]-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione 8a-[(2-iodophenyl)methyl]-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione
Wiley ID 866061