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Benzene, 1-(3-cyclohexyl-2-propynyl)-2-iodo-
SpectraBase Compound ID 3HrVrtmBEBH
InChI InChI=1S/C15H17I/c16-15-12-5-4-10-14(15)11-6-9-13-7-2-1-3-8-13/h4-5,10,12-13H,1-3,7-8,11H2
InChIKey XFKIICIPYBZWKK-UHFFFAOYSA-N
Mol Weight 324.21 g/mol
Molecular Formula C15H17I
Exact Mass 324.037496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7IAAMsaa8j
Name Benzene, 1-(3-cyclohexyl-2-propynyl)-2-iodo-
CAS Registry Number 131251-48-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17I
InChI InChI=1S/C15H17I/c16-15-12-5-4-10-14(15)11-6-9-13-7-2-1-3-8-13/h4-5,10,12-13H,1-3,7-8,11H2
InChIKey XFKIICIPYBZWKK-UHFFFAOYSA-N
Molecular Weight 324.205 g/mol
SMILES C(#CC1CCCCC1)Cc1c(I)cccc1
SPLASH splash10-0629-0925000000-215ffbb759b0c510ad5d
Source of Spectrum C-113-1322-4
Synonyms 1-(3-cyclohexyl-2-propynyl)-2-iodobenzene [3-(2-iodophenyl)-1-propynyl]-cyclohexane
Wiley ID 1322935