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Benzene, 1-(4,4-dimethyl-2-pentynyl)-2-iodo-
SpectraBase Compound ID vC4zrnA5WC
InChI InChI=1S/C13H15I/c1-13(2,3)10-6-8-11-7-4-5-9-12(11)14/h4-5,7,9H,10H2,1-3H3
InChIKey ZXYAXKLRXACZAX-UHFFFAOYSA-N
Mol Weight 298.17 g/mol
Molecular Formula C13H15I
Exact Mass 298.021845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECEJj0UMe1c
Name Benzene, 1-(4,4-dimethyl-2-pentynyl)-2-iodo-
CAS Registry Number 131251-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15I
InChI InChI=1S/C13H15I/c1-13(2,3)10-6-8-11-7-4-5-9-12(11)14/h4-5,7,9H,10H2,1-3H3
InChIKey ZXYAXKLRXACZAX-UHFFFAOYSA-N
Molecular Weight 298.167 g/mol
SMILES C(#Cc1c(I)cccc1)CC(C)(C)C
SPLASH splash10-0a4j-0960000000-48ff9839d97e43e58415
Source of Spectrum C-113-1322-4
Synonyms 1-(2-Iodophenyl)-4,4-dimethyl-pentyne 1-(4,4-dimethyl-1-pentynyl)-2-iodobenzene
Wiley ID 1300584