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3,5-ditert-butyl-1-(2,6-dimethylphenyl)-4-iminocyclohexa-2,5-dien-1-ol
SpectraBase Compound ID DbU6itoMHNh
InChI InChI=1S/C22H31NO/c1-14-10-9-11-15(2)18(14)22(24)12-16(20(3,4)5)19(23)17(13-22)21(6,7)8/h9-13,23-24H,1-8H3
InChIKey NULZJHJDCUVNJB-UHFFFAOYSA-N
Mol Weight 325.5 g/mol
Molecular Formula C22H31NO
Exact Mass 325.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9L575tllgtD
Name 3,5-ditert-butyl-1-(2,6-dimethylphenyl)-4-imino-1-cyclohexa-2,5-dienol
Alternate Name(s) 3,5-ditert-butyl-1-(2,6-dimethylphenyl)-4-imino-cyclohexa-2,5-dien-1-ol 4-azanylidene-3,5-ditert-butyl-1-(2,6-dimethylphenyl)cyclohexa-2,5-dien-1-ol
Comments Less than 3 mono-isotopic peaks
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Formula C22H31NO
InChI InChI=1S/C22H31NO/c1-14-10-9-11-15(2)18(14)22(24)12-16(20(3,4)5)19(23)17(13-22)21(6,7)8/h9-13,23-24H,1-8H3
InChIKey NULZJHJDCUVNJB-UHFFFAOYSA-N
Molecular Weight 325.496 g/mol
SMILES OC1(C=C(C(C(=C1)C(C)(C)C)=N)C(C)(C)C)c1c(cccc1C)C
SPLASH splash10-0a4i-0009000000-38a95a1175b16eb4f30c
Source of Spectrum SO-1977-709-2
Wiley ID 1537015