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Benzenebutanoic acid, 3,5-dimethyl-.beta.-[[(tricyclo[3.3.1.1(3,7)]dec-1-ylmethyl)amino]carbonyl]-
SpectraBase Compound ID 4uTe8lHuocy
InChI InChI=1S/C24H33NO3/c1-15-3-16(2)5-17(4-15)9-21(10-22(26)27)23(28)25-14-24-11-18-6-19(12-24)8-20(7-18)13-24/h3-5,18-21H,6-14H2,1-2H3,(H,25,28)(H,26,27)
InChIKey WROMCWQFYQVXMT-UHFFFAOYSA-N
Mol Weight 383.5 g/mol
Molecular Formula C24H33NO3
Exact Mass 383.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HW0LAJrMuwI
Name Benzenebutanoic acid, 3,5-dimethyl-.beta.-[[(tricyclo[3.3.1.1(3,7)]dec-1-ylmethyl)amino]carbonyl]-
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Formula C24H33NO3
InChI InChI=1S/C24H33NO3/c1-15-3-16(2)5-17(4-15)9-21(10-22(26)27)23(28)25-14-24-11-18-6-19(12-24)8-20(7-18)13-24/h3-5,18-21H,6-14H2,1-2H3,(H,25,28)(H,26,27)
InChIKey WROMCWQFYQVXMT-UHFFFAOYSA-N
Molecular Weight 383.532 g/mol
SMILES N(C(C(CC(=O)O)Cc1cc(C)cc(c1)C)=O)CC12CC3CC(C2)CC(C1)C3
SPLASH splash10-052r-6930000000-1575d1758b2960f27ce9
Source of Spectrum IY-1-4487-7
Synonyms 4-(1-adamantylmethylamino)-3-[(3,5-dimethylphenyl)methyl]-4-oxobutanoic acid 4-(1-adamantylmethylamino)-3-[(3,5-dimethylphenyl)methyl]-4-oxo-butanoic acid 4-(1-adamantylmethylamino)-3-[(3,5-dimethylphenyl)methyl]-4-oxidanylidene-butanoic acid
Wiley ID 1652860