产品名称:北美黄连碱分碱
CAS:4884-68-8
分子式:C11H13NO3.ClH
分子量: 243.689
InChI:InChI=1S/C11H13NO3.ClH/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13;/h4-5,11,13H,2-3,6H2,1H3;1H
InChIKey: DLNQCQJCIITVHC-UHFFFAOYSA-N
Smiles:C12C(O)N(CCC1=CC1OCOC=1C=2)C.Cl
MS
1HNMR
13CNMR
IR1
IR2
Mass
MS-NW-6981 6-methyl-5,6,7,8-tetrahydro-1,3-dioxolo(4,5-g)isoquinolin-5-ol hydrochloride C11H13NO3 HCl (Mass of molecular ion: 207)
Source Temperature: 230 °C Sample Temperature: 180 °C Direct, 75 eV
15.0 2.8 18.0 2.5 27.0 1.8 28.0 1.5 29.0 1.1 35.0 3.7 36.0 23.5 37.0 1.3 38.0 7.2 39.0 5.9 40.0 1.1 41.0 2.3 42.0 20.9 43.0 1.1 50.0 3.7 51.0 6.0 52.0 1.8 53.0 1.6 62.0 3.4 63.0 6.6 64.0 3.0 65.0 5.1 65.5 4.6 66.0 1.5 74.0 1.2 75.0 1.4 76.0 1.5 77.0 5.8 78.0 2.2 79.0 1.2 80.5 1.2 86.0 1.0 87.0 1.5 87.5 1.0 88.0 2.0 89.0 12.5 90.0 6.6 91.0 7.7 92.0 1.6 93.5 3.4 94.0 1.1 94.5 7.7 95.0 2.7 102.0 1.6 103.0 2.8 104.0 1.0 105.0 1.1 115.0 2.3 116.0 3.5 117.0 3.2 118.0 2.2 119.0 1.9 130.0 8.0 131.0 4.5 132.0 4.9 133.0 1.0 135.0 1.2 146.0 1.0 147.0 27.5 148.0 100.0 149.0 12.8 150.0 1.2 159.0 1.6 160.0 3.9 161.0 1.9 162.0 4.9 163.0 1.1 172.0 4.2 173.0 6.8 174.0 2.3 175.0 3.3 176.0 2.8 177.0 1.6 188.0 55.2 189.0 17.5 190.0 83.3 191.0 58.2 192.0 7.2
400 MHz in DMSO-d6 at 50.C
Assign. Shift(ppm) A 9.41 B 7.431 C 7.144 D 6.236 E 3.985 F 3.731 G 3.163
Hz ppm Int.
3759.61 9.408 121 2970.12 7.432 376 2855.38 7.145 257 2492.52 6.237 1000 1601.41 4.008 92 1593.17 3.987 174 1584.63 3.966 106 1491.24 3.732 606 1275.02 3.191 123 1266.78 3.170 211 1258.24 3.149 116
D2O
in DMSO-d6
KBr disc
nujol mull
更多供应商
上海同田生物技术有限公司
MedChemexpress LLC
Musechem
爱必信(上海)生物科技有限公司
陕西缔都医药化工有限公司
ChemeGen 中国
奥默生物技术(上海)有限公司
安耐吉化学&3A(安徽泽升科技有限公司)
天津普西唐生物医药科技有限公司
TargetMol Chemicals Inc.
北美黄连碱分碱(4884-68-8)红外图谱(IR2)相关产品图谱