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3-Iodo-3'-phenyl[2]staffane
SpectraBase Compound ID EKBF0FXvKSx
InChI InChI=1S/C16H17I/c17-16-9-15(10-16,11-16)14-6-13(7-14,8-14)12-4-2-1-3-5-12/h1-5H,6-11H2
InChIKey OLZBUSDRSLSRGL-UHFFFAOYSA-N
Mol Weight 336.22 g/mol
Molecular Formula C16H17I
Exact Mass 336.037496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID cpVpIa1js
Name 3-Iodo-3'-phenyl[2]staffane
Alternate Name(s) 1-{3-iodobicyclo[1.1.1]pentan-1-yl}-3-phenylbicyclo[1.1.1]pentane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17I
InChI InChI=1S/C16H17I/c17-16-9-15(10-16,11-16)14-6-13(7-14,8-14)12-4-2-1-3-5-12/h1-5H,6-11H2
InChIKey OLZBUSDRSLSRGL-UHFFFAOYSA-N
Molecular Weight 336.216 g/mol
SMILES C12(C34CC(C4)(I)C3)CC(C1)(c1ccccc1)C2
SPLASH splash10-015c-6900000000-d21c61d1d892624732e8
Source of Spectrum C-114-617-2
Wiley ID 1332165