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5-(2-(cyclopropylidenemethyl)cyclohex-1-en-1-yl)-1-tosyl-1H-1,2,3-triazole
SpectraBase Compound ID 5RpZqpf9UxY
InChI InChI=1S/C19H21N3O2S/c1-14-6-10-17(11-7-14)25(23,24)22-19(13-20-21-22)18-5-3-2-4-16(18)12-15-8-9-15/h6-7,10-13H,2-5,8-9H2,1H3
InChIKey JYVYKEXFEPTJLC-UHFFFAOYSA-N
Mol Weight 355.46 g/mol
Molecular Formula C19H21N3O2S
Exact Mass 355.135448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdZckSmnS5l
Name 5-(2-(cyclopropylidenemethyl)cyclohex-1-en-1-yl)-1-tosyl-1H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O2S
InChI InChI=1S/C19H21N3O2S/c1-14-6-10-17(11-7-14)25(23,24)22-19(13-20-21-22)18-5-3-2-4-16(18)12-15-8-9-15/h6-7,10-13H,2-5,8-9H2,1H3
InChIKey JYVYKEXFEPTJLC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201402803
Molecular Weight 355.456 g/mol
SMILES C1(c2[n](nnc2)S(c2ccc(cc2)C)(=O)=O)=C(C=C2CC2)CCCC1
SPLASH splash10-00di-0901000000-afa2bfd8cbfe74c40665
Source of Spectrum ACI-53-SMS64-1q
Wiley ID 1782599