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9,10-Ethanoanthracene, 9,10-dihydro-2,3-diiodo-
SpectraBase Compound ID AXJelwj36r4
InChI InChI=1S/C16H12I2/c17-15-7-13-11-5-6-12(14(13)8-16(15)18)10-4-2-1-3-9(10)11/h1-4,7-8,11-12H,5-6H2
InChIKey ZWBXABQFFNEXHD-UHFFFAOYSA-N
Mol Weight 458.08 g/mol
Molecular Formula C16H12I2
Exact Mass 457.90284 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HsEFytel8J9
Name 9,10-Ethanoanthracene, 9,10-dihydro-2,3-diiodo-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.902840386 u
Formula C16H12I2
InChI InChI=1S/C16H12I2/c17-15-7-13-11-5-6-12(14(13)8-16(15)18)10-4-2-1-3-9(10)11/h1-4,7-8,11-12H,5-6H2
InChIKey ZWBXABQFFNEXHD-UHFFFAOYSA-N
Molecular Weight 458.081 g/mol
SMILES C=12C(C3CCC2C2=C3C=CC=C2)=CC(=C(C1)I)I
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957258