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6-Chloro-1-n-octyl-1,4-dihydrochromeno[4,3-d]-1,2,3-triazole

View entire compound with spectra: 1 MS (GC)

6-Chloro-1-n-octyl-1,4-dihydrochromeno[4,3-d]-1,2,3-triazole
SpectraBase Compound ID 9erSdKn1LhO
InChI InChI=1S/C17H22ClN3O/c1-2-3-4-5-6-7-11-21-16-13-9-8-10-14(18)17(13)22-12-15(16)19-20-21/h8-10H,2-7,11-12H2,1H3
InChIKey SGGRAJAMCCYDII-UHFFFAOYSA-N
Mol Weight 319.84 g/mol
Molecular Formula C17H22ClN3O
Exact Mass 319.14514 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LKthd0NIo9
Name 6-Chloro-1-n-octyl-1,4-dihydrochromeno[4,3-d]-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22ClN3O
InChI InChI=1S/C17H22ClN3O/c1-2-3-4-5-6-7-11-21-16-13-9-8-10-14(18)17(13)22-12-15(16)19-20-21/h8-10H,2-7,11-12H2,1H3
InChIKey SGGRAJAMCCYDII-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1005517
Molecular Weight 319.836 g/mol
SMILES c12OCc3nn[n](c3-c1cccc2Cl)CCCCCCCC
SPLASH splash10-0006-9422000000-8b59e28cd62341e61fd5
Source of Spectrum A1-12-2056/SMS11-2l
Synonyms 6-Chloro-1-octyl-1,4-dihydrochromeno[3,4-d][1,2,3]triazole
Wiley ID 1752153