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13C nuclear magnetic resonance spectroscopy (13C NMR) ()
No full textdataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
13C NMR (100 MHz, Chloroform-d [77.0 ppm], ppm) δ = 167.4 (Cq, 2C), 160.5 (Cq), 144.6 (Cq), 142.0 (Cq), 135.9 (Cq), 135.3 (CH), 134.0 (CH, 2C), 132.4 (CH), 132.3 (CH), 131.9 (Cq, 2C), 131.4 (CH), 129.9 (CH), 125.4 (CH), 123.3 (CH, 2C), 117.9 (Cq), 113.1 (Cq), 108.7 (Cq), 60.9 (CH2), 56.0 (CH2), 32.8 (CH2), 13.9 (CH3)
infrared absorption spectroscopy (IR) ()
No full textdataset for infrared absorption spectroscopy (IR)
IR (ATR, ṽ) = 2956 (w), 2929 (w), 2870 (w), 2860 (w), 1717 (vs), 1594 (w), 1548 (vs), 1533 (vs), 1489 (s), 1458 (m), 1441 (m), 1405 (m), 1368 (m), 1329 (m), 1300 (m), 1241 (vs), 1154 (vs), 1112 (vs), 1071 (s), 1038 (vs), 1011 (vs), 983 (s), 911 (m), 839 (s), 803 (vs), 771 (vs), 755 (vs), 731 (vs), 693 (m), 650 (m), 613 (m), 585 (m), 516 (m), 475 (m) cm–1
distortionless enhancement with polarization transfer (DEPT) ()
No full textdataset for distortionless enhancement with polarization transfer (DEPT
heteronuclear single quantum coherence (HSQC) ()
No full textdataset for heteronuclear single quantum coherence (HSQC
mass spectrometry (MS) (1-benzyl-5-[(E)-[di(propan-2-yl)amino]diazenyl]pyrazole-4-carbonitrile)
No full textdataset for mass spectrometry (MS)
MS (EI, 70 eV, 90 °C), m/z (%): 310 (100) [M]+, 210 (43), 100 (44), 91 (68), 58 (14).HRMS–EI (C17H22N6) (m/z): [M]+ Calcd 310.1900; Found 310.1902
heteronuclear multiple bond coherence (HMBC) ()
No full textdataset for heteronuclear multiple bond coherence (HMBC
distortionless enhancement with polarization transfer (DEPT) (1-benzyl-5-[(E)-[di(propan-2-yl)amino]diazenyl]pyrazole-4-carbonitrile)
No full textdataset for distortionless enhancement with polarization transfer (DEPT
mass spectrometry (MS) ()
No full textdataset for mass spectrometry (MS)
MS (FAB, 3-NBA), m/z (%): 346 (100) [M+1]+, 318 (10), 226 (16), 91 (34). HRMS–FAB (C20H20ON5) (m/z): [M + H]+ Calcd 346.1662; Found 346.1661
1H--13C heteronuclear single quantum coherence (1H-13C HSQC) ()
No full textdataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC
13C nuclear magnetic resonance spectroscopy (13C NMR) ()
No full textdataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
13C NMR (100 MHz, Chloroform-d [77.0 ppm], ppm) δ = 170.7 (Cq), 148.4 (Cq), 147.7 (Cq), 143.5 (Cq), 143.1 (Cq), 141.5 (Cq), 133.8 (Cq), 130.7 (CH), 125.8 (CH), 122.8 (CH), 121.2 (CH), 98.3 (CH), 57.4 (CH2), 20.8 (CH3), 11.7 (CH3)