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8,11-diiodotricyclo[4.3.3.0(1,6)]dodecan-7,10-diene
SpectraBase Compound ID 1Sas48oyjDh
InChI InChI=1S/C12H14I2/c13-9-5-11-3-1-2-4-12(11,7-9)8-10(14)6-11/h5,8H,1-4,6-7H2
InChIKey LYYRLRSRYALRSO-UHFFFAOYSA-N
Mol Weight 412.05 g/mol
Molecular Formula C12H14I2
Exact Mass 411.91849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JCVRMiTunc2
Name 8,11-diiodotricyclo[4.3.3.0(1,6)]dodecan-7,10-diene
Appearance Pink solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14I2
InChI InChI=1S/C12H14I2/c13-9-5-11-3-1-2-4-12(11,7-9)8-10(14)6-11/h5,8H,1-4,6-7H2
InChIKey LYYRLRSRYALRSO-UHFFFAOYSA-N
Instrument Name Agilent 5975 GC-122-5532 DB-5MS
Ionization Type EI
Literature Reference DOI 10.1021/jm401340p
Molecular Weight 412.053 g/mol
SMILES C=1(I)CC23CCCCC3(CC(I)=C2)C1
SPLASH splash10-0ar9-0920000000-92349ee7a4f8a8ed09c7
Source of Spectrum AF-56-SM8-anti-19d
Wiley ID 1865452