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(3S)-1-bromo-3-(dibenzylamino)-5-methyl-hexan-2-one
SpectraBase Compound ID 795Tabs2KEE
InChI InChI=1S/C21H26BrNO/c1-17(2)13-20(21(24)14-22)23(15-18-9-5-3-6-10-18)16-19-11-7-4-8-12-19/h3-12,17,20H,13-16H2,1-2H3/t20-/m0/s1
InChIKey BAYSXKWMLMVMKR-FQEVSTJZSA-N
Mol Weight 388.35 g/mol
Molecular Formula C21H26BrNO
Exact Mass 387.119777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJAE75FoEDb
Name (3S)-1-bromo-3-(dibenzylamino)-5-methyl-hexan-2-one
Alternate Name(s) (3S)-3-[bis(phenylmethyl)amino]-1-bromanyl-5-methyl-hexan-2-one (3S)-3-[bis(phenylmethyl)amino]-1-bromo-5-methyl-2-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26BrNO
InChI InChI=1S/C21H26BrNO/c1-17(2)13-20(21(24)14-22)23(15-18-9-5-3-6-10-18)16-19-11-7-4-8-12-19/h3-12,17,20H,13-16H2,1-2H3/t20-/m0/s1
InChIKey BAYSXKWMLMVMKR-FQEVSTJZSA-N
Molecular Weight 388.349 g/mol
SMILES C(C([C@](CC(C)C)(N(Cc1ccccc1)Cc1ccccc1)[H])=O)Br
SPLASH splash10-00kf-9080000000-db816107bba1e50d326b
Source of Spectrum J-64-5051-5
Wiley ID 1530625