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(S)-4-(4-Chlorobenzyloxy)-3-hydroxybutanenitrile
SpectraBase Compound ID 7drfRdkXCOC
InChI InChI=1S/C11H12ClNO2/c12-10-3-1-9(2-4-10)7-15-8-11(14)5-6-13/h1-4,11,14H,5,7-8H2/t11-/m0/s1
InChIKey DESAZRGFHNPIJX-NSHDSACASA-N
Mol Weight 225.67 g/mol
Molecular Formula C11H12ClNO2
Exact Mass 225.055656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TA1sXGKxQo
Name (S)-4-(4-Chlorobenzyloxy)-3-hydroxybutanenitrile
Alternate Name(s) (3S)-4-[(4-chlorobenzyl)oxy]-3-hydroxybutanenitrile (3S)-4-[(4-chlorophenyl)methoxy]-3-hydroxybutanenitrile (3S)-4-[(4-chlorophenyl)methoxy]-3-hydroxy-butanenitrile (3S)-4-[(4-chlorophenyl)methoxy]-3-oxidanyl-butanenitrile
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Formula C11H12ClNO2
InChI InChI=1S/C11H12ClNO2/c12-10-3-1-9(2-4-10)7-15-8-11(14)5-6-13/h1-4,11,14H,5,7-8H2/t11-/m0/s1
InChIKey DESAZRGFHNPIJX-NSHDSACASA-N
Molecular Weight 225.675 g/mol
SMILES O[C@@](CC#N)(COCc1ccc(cc1)Cl)[H]
SPLASH splash10-00di-1900000000-fde43d671f0fd1dbd409
Source of Spectrum QC-17-2910-1
Wiley ID 1638582