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(3E,5E)-12-(1H-pyrazol-5-yl)-2-dodeca-3,5-dien-7,9,11-triynol
SpectraBase Compound ID QJrvBc3eLS
InChI InChI=1S/C15H12N2O/c1-14(18)10-8-6-4-2-3-5-7-9-11-15-12-13-16-17-15/h4,6,8,10,12-14,18H,1H3,(H,16,17)/b6-4+,10-8+
InChIKey YRWCXUYPTUQZNJ-ONNLMXTPSA-N
Mol Weight 236.27 g/mol
Molecular Formula C15H12N2O
Exact Mass 236.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjlD9Egv2Us
Name (3E,5E)-12-(1H-pyrazol-5-yl)-2-dodeca-3,5-dien-7,9,11-triynol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12N2O
InChI InChI=1S/C15H12N2O/c1-14(18)10-8-6-4-2-3-5-7-9-11-15-12-13-16-17-15/h4,6,8,10,12-14,18H,1H3,(H,16,17)/b6-4+,10-8+
InChIKey YRWCXUYPTUQZNJ-ONNLMXTPSA-N
Molecular Weight 236.274 g/mol
SMILES [nH]1ccc(C#CC#CC#C\C=C\C=C\C(C)O)n1
SPLASH splash10-000l-0590000000-76c1016ddd0128f08be2
Source of Spectrum E1-38-5019-7
Synonyms (3E,5E)-12-(1H-pyrazol-5-yl)dodeca-3,5-dien-7,9,11-triyn-2-ol
Wiley ID 1598563