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(3R,4S)-4-(dibenzylamino)-6-methyl-heptan-3-ol
SpectraBase Compound ID 3WqLpX5O2F4
InChI InChI=1S/C22H31NO/c1-4-22(24)21(15-18(2)3)23(16-19-11-7-5-8-12-19)17-20-13-9-6-10-14-20/h5-14,18,21-22,24H,4,15-17H2,1-3H3/t21-,22+/m0/s1
InChIKey SWHDEAWAFSGFPL-FCHUYYIVSA-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 HMPgU5CXQrF
Name (3R,4S)-4-(dibenzylamino)-6-methyl-heptan-3-ol
Alternate Name(s) (3R,4S)-4-[bis(phenylmethyl)amino]-6-methyl-3-heptanol (3R,4S)-4-[bis(phenylmethyl)amino]-6-methyl-heptan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO
InChI InChI=1S/C22H31NO/c1-4-22(24)21(15-18(2)3)23(16-19-11-7-5-8-12-19)17-20-13-9-6-10-14-20/h5-14,18,21-22,24H,4,15-17H2,1-3H3/t21-,22+/m0/s1
InChIKey SWHDEAWAFSGFPL-FCHUYYIVSA-N
Molecular Weight 325.496 g/mol
SMILES O[C@@]([C@@](N(Cc1ccccc1)Cc1ccccc1)(CC(C)C)[H])(CC)[H]
SPLASH splash10-0006-9140000000-c3c5a997cb2e658a80e1
Source of Spectrum J-62-8906-7
Wiley ID 1324245