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(3S)-syn-2-n-Butyl-3-(N-tosylamino)heptan-1-ol
SpectraBase Compound ID LHLCCELXKV2
InChI InChI=1S/C18H31NO3S/c1-4-6-8-16(14-20)18(9-7-5-2)19-23(21,22)17-12-10-15(3)11-13-17/h10-13,16,18-20H,4-9,14H2,1-3H3/t16?,18-/m0/s1
InChIKey NNBJEYYCGWFPAD-DAFXYXGESA-N
Mol Weight 341.51 g/mol
Molecular Formula C18H31NO3S
Exact Mass 341.202465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Li4D1y564sS
Name (3S)-syn-2-n-Butyl-3-(N-tosylamino)heptan-1-ol
Alternate Name(s) (3S)-anti-2-n-Butyl-3-(N-tosylamino)heptan-1-ol N-[(1S)-1-butyl-2-(hydroxymethyl)hexyl]-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H31NO3S
InChI InChI=1S/C18H31NO3S/c1-4-6-8-16(14-20)18(9-7-5-2)19-23(21,22)17-12-10-15(3)11-13-17/h10-13,16,18-20H,4-9,14H2,1-3H3/t16?,18-/m0/s1
InChIKey NNBJEYYCGWFPAD-DAFXYXGESA-N
Molecular Weight 341.510 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@](C(CO)CCCC)(CCCC)[H]
SPLASH splash10-0006-9450000000-c018bbc84eda0d424826
Source of Spectrum J-58-4762-7
Wiley ID 1335878