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2-tert-BUTYL-4A-IODO-HEXAHYDROBENZO[1,3]DIOXIN-4-ONE
SpectraBase Compound ID 62xHRmjohXi
InChI InChI=1S/C8H12O3.C4H10.HI/c9-8-6-3-1-2-4-7(6)10-5-11-8;1-4(2)3;/h6-7H,1-5H2;4H,1-3H3;1H
InChIKey WDYNGTVIEGVQIM-UHFFFAOYSA-N
Mol Weight 342.22 g/mol
Molecular Formula C12H23IO3
Exact Mass 342.06919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4sjEg4MRyz
Name 2-tert-BUTYL-4A-IODO-HEXAHYDROBENZO[1,3]DIOXIN-4-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H19O3I
InChI InChI=1S/C8H12O3.C4H10.HI/c9-8-6-3-1-2-4-7(6)10-5-11-8;1-4(2)3;/h6-7H,1-5H2;4H,1-3H3;1H
InChIKey WDYNGTVIEGVQIM-UHFFFAOYSA-N
Molecular Weight 342.0645
SMILES I.C1C2C(OCOC2=O)CCC1.CC(C)C
SPLASH splash10-057l-9100000000-70e0ded7385f5a60af75
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany