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4-Nitrocatechol, 2TMS
SpectraBase Compound ID 4D5F6ygYLKQ
InChI InChI=1S/C12H21NO4Si2/c1-18(2,3)16-11-8-7-10(13(14)15)9-12(11)17-19(4,5)6/h7-9H,1-6H3
InChIKey GIVUCFXWKODBAK-UHFFFAOYSA-N
Mol Weight 299.47 g/mol
Molecular Formula C12H21NO4Si2
Exact Mass 299.100911 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJWIcs3wKe4
Name 4-Nitrocatechol, 2TMS
Comments Derivatization type: 2 TMS (mass: 299.101); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000867; Note: The molecular formula of the structure shown is C6H5NO4 - which differs from the formula reported for the mass spectrum (C12H21NO4Si2)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO4Si2
InChI InChI=1S/C12H21NO4Si2/c1-18(2,3)16-11-8-7-10(13(14)15)9-12(11)17-19(4,5)6/h7-9H,1-6H3
InChIKey GIVUCFXWKODBAK-UHFFFAOYSA-N
Molecular Weight 299.473 g/mol
SMILES c1cc(c(cc1[N+]([O-])=O)O[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-001i-1940000000-b7f60fb9dd8027d91323
Source of Spectrum FM-2019-867-0
Synonyms ((4-nitro-1,2-phenylene)bis(oxy))bis(trimethylsilane)
Wiley ID 1818536