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(S)-4-(2,4-Dichlorobenzyloxy)-3-hydroxybutanenitrile
SpectraBase Compound ID HryewJ7v40N
InChI InChI=1S/C11H11Cl2NO2/c12-9-2-1-8(11(13)5-9)6-16-7-10(15)3-4-14/h1-2,5,10,15H,3,6-7H2/t10-/m0/s1
InChIKey IYKHAWKQQZGKKJ-JTQLQIEISA-N
Mol Weight 260.12 g/mol
Molecular Formula C11H11Cl2NO2
Exact Mass 259.016684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QsM43K6pcb
Name (S)-4-(2,4-Dichlorobenzyloxy)-3-hydroxybutanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11Cl2NO2
InChI InChI=1S/C11H11Cl2NO2/c12-9-2-1-8(11(13)5-9)6-16-7-10(15)3-4-14/h1-2,5,10,15H,3,6-7H2/t10-/m0/s1
InChIKey IYKHAWKQQZGKKJ-JTQLQIEISA-N
Molecular Weight 260.120 g/mol
SMILES O[C@@](CC#N)(COCc1c(cc(cc1)Cl)Cl)[H]
SPLASH splash10-001i-1910000000-d00ef25ce1afdb80806a
Source of Spectrum QC-17-2910-1
Synonyms (3S)-4-[(2,4-dichlorobenzyl)oxy]-3-hydroxybutanenitrile (3S)-4-[(2,4-dichlorophenyl)methoxy]-3-hydroxybutanenitrile (3S)-4-[(2,4-dichlorophenyl)methoxy]-3-hydroxy-butanenitrile (3S)-4-[(2,4-dichlorophenyl)methoxy]-3-oxidanyl-butanenitrile
Wiley ID 1638581