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(anti)-2,4-Pentadiynal-5-deuterio-Tosylhydrazone
SpectraBase Compound ID HNCylkO57zH
InChI InChI=1S/C12H10N2O2S/c1-3-11-8-9-13-14(11)17(15,16)12-6-4-10(2)5-7-12/h1,4-9H,2H3/i1D
InChIKey JGIVVDYYABRZFP-MICDWDOJSA-N
Mol Weight 247.29 g/mol
Molecular Formula C12H92DN2O2S
Exact Mass 247.052575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ACFSMhDKhA
Name (anti)-2,4-Pentadiynal-5-deuterio-Tosylhydrazone
Alternate Name(s) 5-(2'-Deuterioethynyl)-1(N)-(p-tolylsulfonyl)-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9DN2O2S
InChI InChI=1S/C12H10N2O2S/c1-3-11-8-9-13-14(11)17(15,16)12-6-4-10(2)5-7-12/h1,4-9H,2H3/i1D
InChIKey JGIVVDYYABRZFP-MICDWDOJSA-N
Molecular Weight 247.290 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)ncc1)C#C[2D]
SPLASH splash10-0006-9300000000-f39708a2d79b4c95b5ee
Source of Spectrum C-128-3301-anti-7b
Wiley ID 1701813