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4-Hydroxy-3-(3-methylbenzyllamino)-2-phenylcyclobutenone
SpectraBase Compound ID LvliQMYHCFU
InChI InChI=1S/C18H17NO2/c1-12-6-5-7-13(10-12)11-19-16-15(17(20)18(16)21)14-8-3-2-4-9-14/h2-10,18-19,21H,11H2,1H3
InChIKey JBEQPADEVMLDSD-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Fk0HpDvVlw
Name 4-Hydroxy-3-(3-methylbenzyllamino)-2-phenylcyclobutenone
Alternate Name(s) 4-hydroxy-3-[(3-methylphenyl)methylamino]-2-phenyl-1-cyclobut-2-enone 4-hydroxy-3-[(3-methylphenyl)methylamino]-2-phenylcyclobut-2-en-1-one 4-hydroxy-3-(m-tolylmethylamino)-2-phenyl-cyclobut-2-en-1-one 3-[(3-methylphenyl)methylamino]-4-oxidanyl-2-phenyl-cyclobut-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-12-6-5-7-13(10-12)11-19-16-15(17(20)18(16)21)14-8-3-2-4-9-14/h2-10,18-19,21H,11H2,1H3
InChIKey JBEQPADEVMLDSD-UHFFFAOYSA-N
Molecular Weight 279.339 g/mol
SMILES OC1C(C(=C1NCc1cc(C)ccc1)c1ccccc1)=O
SPLASH splash10-0a4i-0920000000-6a4667c1a32e1671a69f
Source of Spectrum K-2001-69-15
Wiley ID 1578419