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(S)-4-(2,4,6-Trimethylbenzyloxy)-3-hydroxybutanenitrile

View entire compound with spectra: 1 MS (GC)

(S)-4-(2,4,6-Trimethylbenzyloxy)-3-hydroxybutanenitrile
SpectraBase Compound ID JbR0g4Rqs5M
InChI InChI=1S/C14H19NO2/c1-10-6-11(2)14(12(3)7-10)9-17-8-13(16)4-5-15/h6-7,13,16H,4,8-9H2,1-3H3/t13-/m0/s1
InChIKey YQQBNUMMGVARHK-ZDUSSCGKSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7X19RmZrRrW
Name (S)-4-(2,4,6-Trimethylbenzyloxy)-3-hydroxybutanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c1-10-6-11(2)14(12(3)7-10)9-17-8-13(16)4-5-15/h6-7,13,16H,4,8-9H2,1-3H3/t13-/m0/s1
InChIKey YQQBNUMMGVARHK-ZDUSSCGKSA-N
Molecular Weight 233.311 g/mol
SMILES O[C@@](CC#N)(COCc1c(cc(cc1C)C)C)[H]
SPLASH splash10-001i-1910000000-2f99e8d6f5aec2771dc6
Source of Spectrum QC-17-2911-1
Synonyms (3S)-3-hydroxy-4-(mesitylmethoxy)butanenitrile (3S)-3-hydroxy-4-[(2,4,6-trimethylphenyl)methoxy]butanenitrile (3S)-3-oxidanyl-4-[(2,4,6-trimethylphenyl)methoxy]butanenitrile
Wiley ID 1638578