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1-((1S,2S)-2-azido-1-(3,4-dimethoxyphenyl)cyclohexyl)ethanone
SpectraBase Compound ID HoGxQl0NZMI
InChI InChI=1S/C16H21N3O3/c1-11(20)16(9-5-4-6-15(16)18-19-17)12-7-8-13(21-2)14(10-12)22-3/h7-8,10,15H,4-6,9H2,1-3H3/t15-,16-/m0/s1
InChIKey AZCFFUOZHOKVTQ-HOTGVXAUSA-N
Mol Weight 303.36 g/mol
Molecular Formula C16H21N3O3
Exact Mass 303.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bbsVnvrX9u
Name 1-((1S,2S)-2-azido-1-(3,4-dimethoxyphenyl)cyclohexyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N3O3
InChI InChI=1S/C16H21N3O3/c1-11(20)16(9-5-4-6-15(16)18-19-17)12-7-8-13(21-2)14(10-12)22-3/h7-8,10,15H,4-6,9H2,1-3H3/t15-,16-/m0/s1
InChIKey AZCFFUOZHOKVTQ-HOTGVXAUSA-N
Literature Reference DOI 10.1039/c4cc04707a
Molecular Weight 303.362 g/mol
SMILES C1CC[C@@]([C@@](C1)(C(C)=O)c1cc(c(cc1)OC)OC)(N=[N+]=[N-])[H]
SPLASH splash10-0pb9-9451000000-182f8605bac5acc0879f
Source of Spectrum KD-50-10805/SMS15-2f
Wiley ID 1754803