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4-[(1S)-7-bromanyl-1-oxidanyl-heptyl]benzenecarbonitrile
SpectraBase Compound ID 8CzwNgqdkuE
InChI InChI=1S/C14H18BrNO/c15-10-4-2-1-3-5-14(17)13-8-6-12(11-16)7-9-13/h6-9,14,17H,1-5,10H2/t14-/m0/s1
InChIKey BXPUKMRSHUEUGF-AWEZNQCLSA-N
Mol Weight 296.21 g/mol
Molecular Formula C14H18BrNO
Exact Mass 295.057177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lnK8zMlGlW
Name 4-[(1S)-7-bromanyl-1-oxidanyl-heptyl]benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18BrNO
InChI InChI=1S/C14H18BrNO/c15-10-4-2-1-3-5-14(17)13-8-6-12(11-16)7-9-13/h6-9,14,17H,1-5,10H2/t14-/m0/s1
InChIKey BXPUKMRSHUEUGF-AWEZNQCLSA-N
Molecular Weight 296.208 g/mol
SMILES O[C@](c1ccc(C#N)cc1)(CCCCCCBr)[H]
SPLASH splash10-001i-0900000000-9ae5dcbd7b2335c57b6e
Source of Spectrum J-61-8242-56
Synonyms 4-[(1S)-7-bromo-1-hydroxy-heptyl]benzonitrile
Wiley ID 1298067