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Tricarbonyl-[1-(1'-acetoxy-3'-phenylpropargyl)-2-chlorophenyl]-chromium
SpectraBase Compound ID H9Dh8AXhPrW
InChI InChI=1S/C17H13ClO2.3CO.Cr/c1-13(19)20-17(15-9-5-6-10-16(15)18)12-11-14-7-3-2-4-8-14;3*1-2;/h2-10,17H,1H3;;;;
InChIKey HQWOOUMAKOPEGX-UHFFFAOYSA-N
Mol Weight 420.768 g/mol
Molecular Formula C20H13ClCrO5
Exact Mass 419.985656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2ItXRJRbde
Name Tricarbonyl-[1-(1'-acetoxy-3'-phenylpropargyl)-2-chlorophenyl]-chromium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13ClCrO5
InChI InChI=1S/C17H13ClO2.3CO.Cr/c1-13(19)20-17(15-9-5-6-10-16(15)18)12-11-14-7-3-2-4-8-14;3*1-2;/h2-10,17H,1H3;;;;
InChIKey HQWOOUMAKOPEGX-UHFFFAOYSA-N
Molecular Weight 420.768 g/mol
SMILES [Cr].C(#Cc1ccccc1)C(c1c(Cl)cccc1)OC(=O)C.[O+]#[C-].[O+]#[C-].[O+]#[C-]
SPLASH splash10-001i-9141000000-84609a128ddd5e2e73f1
Source of Spectrum C-123-3447-3d
Wiley ID 1700662