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3-(1-besylhex-5-ynyl)-5-phenyl-1,2,4-triazine
SpectraBase Compound ID B1q9n4YpWmr
InChI InChI=1S/C21H19N3O2S/c1-2-3-6-15-20(27(25,26)18-13-9-5-10-14-18)21-23-19(16-22-24-21)17-11-7-4-8-12-17/h1,4-5,7-14,16,20H,3,6,15H2
InChIKey OZZWPPCRFPPHKP-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C21H19N3O2S
Exact Mass 377.119798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUx5Z914zdZ
Name 3-(1-besylhex-5-ynyl)-5-phenyl-1,2,4-triazine
Alternate Name(s) 3-[1-(benzenesulfonyl)hex-5-ynyl]-5-phenyl-1,2,4-triazine 5-Phenyl-3-[1-(phenylsulfonyl)hex-5-ynyl]-1,2,4-triazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O2S
InChI InChI=1S/C21H19N3O2S/c1-2-3-6-15-20(27(25,26)18-13-9-5-10-14-18)21-23-19(16-22-24-21)17-11-7-4-8-12-17/h1,4-5,7-14,16,20H,3,6,15H2
InChIKey OZZWPPCRFPPHKP-UHFFFAOYSA-N
Molecular Weight 377.462 g/mol
SMILES c1(nncc(n1)-c1ccccc1)C(CCCC#C)S(=O)(=O)c1ccccc1
SPLASH splash10-000i-2792000000-7b3fc7ff5fade52adf5f
Source of Spectrum E2-50-465-13
Wiley ID 1555860