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2-Methyl-4-[(phenyl)iodo]benz[b]oxepine-3,5-(2H,4H)-dione
SpectraBase Compound ID HBnA5MdwQno
InChI InChI=1S/C17H13IO3/c1-11-15(19)17(18,12-7-3-2-4-8-12)16(20)13-9-5-6-10-14(13)21-11/h2-11H,1H3
InChIKey DMBWRPBXOSMOMF-UHFFFAOYSA-N
Mol Weight 392.19 g/mol
Molecular Formula C17H13IO3
Exact Mass 391.990939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XLidOJIDA
Name 2-Methyl-4-[(phenyl)iodo]benz[b]oxepine-3,5-(2H,4H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13IO3
InChI InChI=1S/C17H13IO3/c1-11-15(19)17(18,12-7-3-2-4-8-12)16(20)13-9-5-6-10-14(13)21-11/h2-11H,1H3
InChIKey DMBWRPBXOSMOMF-UHFFFAOYSA-N
Molecular Weight 392.192 g/mol
SMILES C1(C(c2c(cccc2)OC(C1=O)C)=O)(c1ccccc1)I
SPLASH splash10-0fb9-9180000000-8dbde3a74ff1a7b57971
Source of Spectrum J-58-4887-2
Synonyms 4-iodo-2-methyl-4-phenyl-1-benzoxepin-3,5(2H,4H)-dione
Wiley ID 1365620