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Warfarin TMS
SpectraBase Compound ID 5mvjUXeBX08
InChI InChI=1S/C22H24O4Si/c1-15(23)14-18(16-10-6-5-7-11-16)20-21(26-27(2,3)4)17-12-8-9-13-19(17)25-22(20)24/h5-13,18H,14H2,1-4H3
InChIKey ZGTLYCBMQNUUBB-UHFFFAOYSA-N
Mol Weight 380.52 g/mol
Molecular Formula C22H24O4Si
Exact Mass 380.144386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5IXO7hVk1G2
Name Warfarin TMS @
Classification Anticoagulant Rodenticide
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 380.144385784 u
Formula C22H24O4Si
InChI InChI=1S/C22H24O4Si/c1-15(23)14-18(16-10-6-5-7-11-16)20-21(26-27(2,3)4)17-12-8-9-13-19(17)25-22(20)24/h5-13,18H,14H2,1-4H3
InChIKey ZGTLYCBMQNUUBB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 380.515 g/mol
SMILES C1(=C(c2ccccc2OC1=O)O[Si](C)(C)C)C(CC(=O)C)c1ccccc1
SPLASH splash10-0019-5769000000-545c1abf36eed6d3922d
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Pyranocoumarin-M (O-demethyl-) artifact TMS
Technique GC/MS
Wiley ID MMPW6e_4970