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(1S,2R)-(-)-2-Hexyl-1-(4-methoxyphenyl)cyclopropanecarbonitrile
SpectraBase Compound ID KWQAscKYzqd
InChI InChI=1S/C17H23NO/c1-3-4-5-6-7-15-12-17(15,13-18)14-8-10-16(19-2)11-9-14/h8-11,15H,3-7,12H2,1-2H3/t15-,17-/m1/s1
InChIKey FWKSJHXLAFZORI-NVXWUHKLSA-N
Mol Weight 257.38 g/mol
Molecular Formula C17H23NO
Exact Mass 257.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3KYBi9bcS2
Name (1S,2R)-(-)-2-Hexyl-1-(4-methoxyphenyl)cyclopropanecarbonitrile
Alternate Name(s) (1S,2R)-2-hexyl-1-(4-methoxyphenyl)cyclopropanecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO
InChI InChI=1S/C17H23NO/c1-3-4-5-6-7-15-12-17(15,13-18)14-8-10-16(19-2)11-9-14/h8-11,15H,3-7,12H2,1-2H3/t15-,17-/m1/s1
InChIKey FWKSJHXLAFZORI-NVXWUHKLSA-N
Literature Reference DOI 10.1002/adsc.200900222
Molecular Weight 257.377 g/mol
SMILES C1[C@]([C@]1(C#N)c1ccc(cc1)OC)(CCCCCC)[H]
SPLASH splash10-0a4i-0910000000-cc82d9105c7b6871280a
Source of Spectrum ASC-351-1801/SM11-6fG
Wiley ID 1763288