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5-Iodo-3-phenylhex-5-enoic acid

View entire compound with spectra: 1 MS (GC)

5-Iodo-3-phenylhex-5-enoic acid
SpectraBase Compound ID CKN7PamTkrT
InChI InChI=1S/C12H13IO2/c1-9(13)7-11(8-12(14)15)10-5-3-2-4-6-10/h2-6,11H,1,7-8H2,(H,14,15)
InChIKey NGCFEVNORORZCM-UHFFFAOYSA-N
Mol Weight 316.14 g/mol
Molecular Formula C12H13IO2
Exact Mass 315.996025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aqDlids8qT
Name 5-Iodo-3-phenylhex-5-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13IO2
InChI InChI=1S/C12H13IO2/c1-9(13)7-11(8-12(14)15)10-5-3-2-4-6-10/h2-6,11H,1,7-8H2,(H,14,15)
InChIKey NGCFEVNORORZCM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol9015578
Molecular Weight 316.138 g/mol
SMILES OC(=O)CC(CC(I)=C)c1ccccc1
SPLASH splash10-056r-2900000000-55d253d1c126a8392edf
Source of Spectrum A1-11-4084/SMS7-5
Wiley ID 1757308