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3,5-ditert-butyl-4-nitro-phenol
SpectraBase Compound ID EcmVJCGVvKU
InChI InChI=1S/C14H21NO3/c1-13(2,3)10-7-9(16)8-11(14(4,5)6)12(10)15(17)18/h7-8,16H,1-6H3
InChIKey GGOONHNUTIVUPA-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JF55DIj1ZQ0
Name 3,5-ditert-butyl-4-nitro-phenol
CAS Registry Number 94037-84-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-13(2,3)10-7-9(16)8-11(14(4,5)6)12(10)15(17)18/h7-8,16H,1-6H3
InChIKey GGOONHNUTIVUPA-UHFFFAOYSA-N
Molecular Weight 251.326 g/mol
SMILES Oc1cc(c(N(=O)=O)c(C(C)(C)C)c1)C(C)(C)C
SPLASH splash10-000i-0090000000-291f1d0b43d69d4a34ef
Source of Spectrum I-62-2809-0
Wiley ID 1254572