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3,5-DI-TERT.-BUTYL-2-NITROPHENOL
SpectraBase Compound ID BQcwnH6P8Ob
InChI InChI=1S/C14H21NO3/c1-13(2,3)9-7-10(14(4,5)6)12(15(17)18)11(16)8-9/h7-8,16H,1-6H3
InChIKey BXZHVNRCHYCYFC-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 9YvpJ0wC0fO
Name Phenol, 3,5-bis(1,1-dimethylethyl)-2-nitro-
CAS Registry Number 3114-67-8
Comments Less than 3 mono-isotopic peaks
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Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-13(2,3)9-7-10(14(4,5)6)12(15(17)18)11(16)8-9/h7-8,16H,1-6H3
InChIKey BXZHVNRCHYCYFC-UHFFFAOYSA-N
Molecular Weight 251.326 g/mol
SMILES Oc1c(N(=O)=O)c(cc(c1)C(C)(C)C)C(C)(C)C
SPLASH splash10-000i-0090000000-6db49a74f4ef70cd609b
Source of Spectrum I-62-2809-0
Synonyms 3,5-ditert-butyl-2-nitro-phenol
Wiley ID 1254571