产品名称 3-氯-2-丁酮
CAS号4091-39-8
分子式C4H7ClO
分子量106.55
InChIInChI=1S/C4H7ClO/c1-3(5)4(2)6/h3H,1-2H3
InChIKeyOIMRLHCSLQUXLL-UHFFFAOYSA-N
SmilesCC(=O)C(Cl)C
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Mass
MS-NW-4352 3-chloro-2-butanone C4H7ClO (Mass of molecular ion: 106)
Source Temperature: 220 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 3.8 26.0 2.2 27.0 8.8 29.0 1.2 39.0 1.2 41.0 1.3 42.0 3.4 43.0 100.0 44.0 2.3 55.0 1.1 57.0 1.3 63.0 3.3 65.0 1.0 106.0 5.8 108.0 1.9
90 MHz in CDCl3
Assign. Shift(ppm) A 4.325 B 2.333 C 1.608
Hz ppm Int.
399.25 4.458 35 392.31 4.381 101 385.44 4.304 109 378.63 4.228 42 208.25 2.326 1000 205.25 2.292 37 146.75 1.639 546 144.56 1.615 41 143.94 1.608 38 139.88 1.562 513
in CDCl3
liquid film
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3-氯-2-丁酮(4091-39-8)核磁图(13CNMR) 相关产品图谱