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6-tert-Butyl-3-n-pentadecyl-2,4-dinitrophenol
SpectraBase Compound ID Ewd39Vpfpmi
InChI InChI=1S/C25H42N2O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-22(26(29)30)19-21(25(2,3)4)24(28)23(20)27(31)32/h19,28H,5-18H2,1-4H3
InChIKey SPDOWEQBSMEIGO-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C25H42N2O5
Exact Mass 450.309372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SSgA9K26w5
Name 6-tert-Butyl-3-n-pentadecyl-2,4-dinitrophenol
Alternate Name(s) 6-tert-butyl-2,4-dinitro-3-pentadecylphenol
Comments Less than 3 mono-isotopic peaks
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Formula C25H42N2O5
InChI InChI=1S/C25H42N2O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-22(26(29)30)19-21(25(2,3)4)24(28)23(20)27(31)32/h19,28H,5-18H2,1-4H3
InChIKey SPDOWEQBSMEIGO-UHFFFAOYSA-N
Molecular Weight 450.620 g/mol
SMILES Oc1c(c(c(cc1C(C)(C)C)N(=O)=O)CCCCCCCCCCCCCCC)N(=O)=O
SPLASH splash10-001i-0000900000-3179230626addaf57d08
Source of Spectrum F-62-6118-16
Wiley ID 1633913