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Mycophenoxylate
SpectraBase Compound ID 3BcjBz3TbXr
InChI InChI=1S/C18H22O6/c1-10(6-8-14(19)22-3)5-7-12-16(20)15-13(9-24-18(15)21)11(2)17(12)23-4/h5,20H,6-9H2,1-4H3/b10-5-
InChIKey ZPXRQFLATDNYSS-YHYXMXQVSA-N
Mol Weight 334.37 g/mol
Molecular Formula C18H22O6
Exact Mass 334.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hktme4ZhrOw
Name Mycophenolate methyl artifact (334)
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C18H22O6
InChI InChI=1S/C18H22O6/c1-10(6-8-14(19)22-3)5-7-12-16(20)15-13(9-24-18(15)21)11(2)17(12)23-4/h5,20H,6-9H2,1-4H3/b10-5-
InChIKey ZPXRQFLATDNYSS-YHYXMXQVSA-N
SMILES Oc1c2c(COC2=O)c(c(c1C\C=C\(C)CCC(=O)OC)OC)C
SPLASH splash10-0a4j-2591000000-62e88a9274333f0ab18f
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences