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4-Hydoxy-4-[benzoyloxy)methyl]-1-oxo-3-ethoxy-4-butyl-2-cyclobutenone
SpectraBase Compound ID JqCcOFlCfrQ
InChI InChI=1S/C18H22O5/c1-3-5-11-14-16(20)18(21,17(14)22-4-2)12-15(19)23-13-9-7-6-8-10-13/h6-10,21H,3-5,11-12H2,1-2H3
InChIKey VPVYUZPMZFWGDH-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UhuM9Q7EzW
Name 4-Hydoxy-4-[benzoyloxy)methyl]-1-oxo-3-ethoxy-4-butyl-2-cyclobutenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-3-5-11-14-16(20)18(21,17(14)22-4-2)12-15(19)23-13-9-7-6-8-10-13/h6-10,21H,3-5,11-12H2,1-2H3
InChIKey VPVYUZPMZFWGDH-UHFFFAOYSA-N
Molecular Weight 318.369 g/mol
SMILES OC1(C(OCC)=C(C1=O)CCCC)CC(Oc1ccccc1)=O
SPLASH splash10-002b-0920000000-becf4ca465360eec6241
Source of Spectrum F-50-7795-30
Wiley ID 1318535