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heteronuclear multiple bond coherence (HMBC) ()
No full textdataset for heteronuclear multiple bond coherence (HMBC
distortionless enhancement with polarization transfer (DEPT) ()
No full textdataset for distortionless enhancement with polarization transfer (DEPT
heteronuclear single quantum coherence (HSQC) (3-azido-1-[(4-bromophenyl)methyl]pyrazole)
No full textdataset for heteronuclear single quantum coherence (HSQC
heteronuclear single quantum coherence (HSQC) (3-azido-1-cyclopentylpyrazole)
No full textdataset for heteronuclear single quantum coherence (HSQC
Short-RInChIKey=SA-FUHFF-UHFFFADPSC-CEJMUQXTWW-UHFFFADPSC-NUHFF-NUHFF-NUHFF-ZZZ
No full text(E)-1-cyclopentyl-3-(3,3-diisopropyltriaz-1-en-1-yl)-1H-pyrazole (211 mg, 801 μmol, 1.00 equiv) was dissolved in methylene chloride (20 mL). The solution was cooled to 0 °C and then azido(trimethyl)silane (692 mg, 797 μL, 6.01 mmol, 7.50 equiv) and 2,2,2-trifluoroacetic acid (913 mg, 613 μL, 8.01 mmol, 10.0 equiv) were added. The reaction mixture was slowly warmed to 50 °C while constantly stirring. The reaction progress was monitored via TLC. The reaction was finished after 16 hours of stirring at 50 °C
mass spectrometry (MS) ()
No full textdataset for mass spectrometry (MS)
MS (EI, 70 eV, 170 °C), m/z (%): 531 (10), 441 (11), 283 (4) [M]+, 255 (100), 224 (28), 214 (18), 196 (14), 162 (10), 155 (15), 129 (16), 101 (12), 89 (15).HRMS–EI (C14H13O2N5) (m/z): [M]+ Calcd 283.1064; Found 283.1065
infrared absorption spectroscopy (IR) ()
No full textdataset for infrared absorption spectroscopy (IR)
IR (ATR, ṽ) = 3128 (w), 3118 (w), 3078 (w), 2952 (m), 2927 (m), 2868 (m), 2809 (w), 2747 (w), 2690 (w), 1735 (m), 1727 (m), 1537 (vs), 1487 (w), 1463 (w), 1453 (w), 1436 (m), 1380 (m), 1363 (w), 1322 (m), 1313 (m), 1249 (w), 1231 (vs), 1204 (s), 1194 (s), 1156 (m), 1103 (m), 1082 (w), 1037 (vs), 938 (s), 919 (m), 899 (w), 841 (m), 806 (m), 766 (vs), 754 (vs), 713 (w), 693 (w), 646 (w), 618 (w), 551 (w), 541 (w), 531 (w), 507 (w), 490 (w), 445 (w), 402 (w), 378 (w) cm–1
1H nuclear magnetic resonance spectroscopy (1H NMR) ()
No full textdataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
1H NMR (400 MHz, Chloroform-d [7.27 ppm], ppm) δ = 8.70 (s, 1H), 7.49 (d, J = 2.4 Hz, 1H), 6.72 (d, J = 2.3 Hz, 1H), 4.69–4.62 (m, 1H), 3.99 (s, 3H), 2.23–2.14 (m, 2H), 2.09–2.00 (m, 2H), 1.95–1.85 (m, 2H), 1.79–1.68 (m, 2H). Impurity: Spectrum contains cyclohexane at 1.42 ppm
distortionless enhancement with polarization transfer (DEPT) ()
No full textdataset for distortionless enhancement with polarization transfer (DEPT
19F nuclear magnetic resonance spectroscopy (19F NMR) ()
No full textdataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)
19F NMR (376 MHz, ppm) δ = -108.08