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(S*,S*)-anti-3,4-dimethyl-2-hexanone
SpectraBase Compound ID 7T5MwQOf160
InChI InChI=1S/C8H16O/c1-5-6(2)7(3)8(4)9/h6-7H,5H2,1-4H3/t6-,7-/m0/s1
InChIKey YGXOERUAAWTDEV-BQBZGAKWSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H16O
Exact Mass 128.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7iHnmpZUmc2
Name (S*,S*)-anti-3,4-dimethyl-2-hexanone
CAS Registry Number 119756-02-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-5-6(2)7(3)8(4)9/h6-7H,5H2,1-4H3/t6-,7-/m0/s1
InChIKey YGXOERUAAWTDEV-BQBZGAKWSA-N
Molecular Weight 128.215 g/mol
SMILES C([C@]([C@](CC)(C)[H])(C)[H])(=O)C
SPLASH splash10-0007-9000000000-edff0b9f61e2142f83a4
Source of Spectrum F-44-3584-0
Synonyms (3S,4S)-3,4-dimethyl-2-hexanone
Wiley ID 1131766