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3-Butyl-3,4,5,6-tetrahydrobenzo[3,4]cyclohepta[1, 2-d][1,2,3]triazole

View entire compound with spectra: 1 MS (GC)

3-Butyl-3,4,5,6-tetrahydrobenzo[3,4]cyclohepta[1, 2-d][1,2,3]triazole
SpectraBase Compound ID 9Ct0GcxtmAl
InChI InChI=1S/C15H19N3/c1-2-3-11-18-14-10-6-8-12-7-4-5-9-13(12)15(14)16-17-18/h4-5,7,9H,2-3,6,8,10-11H2,1H3
InChIKey BDHJQVVEHCVLKZ-UHFFFAOYSA-N
Mol Weight 241.34 g/mol
Molecular Formula C15H19N3
Exact Mass 241.157898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G14j8HUFPkN
Name 3-Butyl-3,4,5,6-tetrahydrobenzo[3,4]cyclohepta[1, 2-d][1,2,3]triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19N3
InChI InChI=1S/C15H19N3/c1-2-3-11-18-14-10-6-8-12-7-4-5-9-13(12)15(14)16-17-18/h4-5,7,9H,2-3,6,8,10-11H2,1H3
InChIKey BDHJQVVEHCVLKZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201800514
Molecular Weight 241.338 g/mol
SMILES c1cc-2c(cc1)CCCc1c2nn[n]1CCCC
SPLASH splash10-0a4i-0920000000-6883c314a38e57e9b306
Source of Spectrum AJO-8-SM12-5p
Synonyms 3-Butyl-3,4,5,6-tetrahydrobenzo[3,4]cyclohepta[1,2-d][1,2,3]triazole
Wiley ID 1819286