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Cyclohex-2-enyl 4-iodobenzoate
SpectraBase Compound ID FXKLJLmdNqK
InChI InChI=1S/C13H13IO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h2,4,6-9,12H,1,3,5H2
InChIKey FFLDSYSJPVQXSF-UHFFFAOYSA-N
Mol Weight 328.15 g/mol
Molecular Formula C13H13IO2
Exact Mass 327.996025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSmghotilxx
Name Cyclohex-2-enyl 4-iodobenzoate
Alternate Name(s) Cyclohex-2-en-1-yl 4-iodobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13IO2
InChI InChI=1S/C13H13IO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h2,4,6-9,12H,1,3,5H2
InChIKey FFLDSYSJPVQXSF-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc09393c
Molecular Weight 328.149 g/mol
SMILES c1cc(ccc1I)C(OC1C=CCCC1)=O
SPLASH splash10-001i-5091000000-e1ebb1b7c303b0a675c9
Source of Spectrum KD-51-2361/SM-3ga
Wiley ID 1757544