Debug Info

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GK2wyziNcSb
spectrumID
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GK2wyziNcSb
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2-(4-Methoxyphenylamino)-2-(trifluoromethyl)octanenitrile
SpectraBase Compound ID 5QpUq69t7Tr
InChI InChI=1S/C16H21F3N2O/c1-3-4-5-6-11-15(12-20,16(17,18)19)21-13-7-9-14(22-2)10-8-13/h7-10,21H,3-6,11H2,1-2H3
InChIKey UOVMBKZWAYMRRP-UHFFFAOYSA-N
Mol Weight 314.35 g/mol
Molecular Formula C16H21F3N2O
Exact Mass 314.160598 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GK2wyziNcSb
Name 2-(4-Methoxyphenylamino)-2-(trifluoromethyl)octanenitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21F3N2O
InChI InChI=1S/C16H21F3N2O/c1-3-4-5-6-11-15(12-20,16(17,18)19)21-13-7-9-14(22-2)10-8-13/h7-10,21H,3-6,11H2,1-2H3
InChIKey UOVMBKZWAYMRRP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201200289
Molecular Weight 314.352 g/mol
SMILES N(c1ccc(OC)cc1)C(CCCCCC)(C(F)(F)F)C#N
SPLASH splash10-00r6-9210000000-d048e64b70412a1f5e38
Source of Spectrum CAJ-7-1759/SM8-3s
Synonyms 2-((4-methoxyphenyl)amino)-2-(trifluoromethyl)octanenitrile
Wiley ID 1773258
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