nmr1 29 8.142 7.970 7.284 6.062 4.010 3.327 3.300 3.280 3 ... · Spec. Reported : MS Integration...
Transcript of nmr1 29 8.142 7.970 7.284 6.062 4.010 3.327 3.300 3.280 3 ... · Spec. Reported : MS Integration...
2.02.53.03.54.04.55.05.56.06.57.07.58.08.5 ppm
1.897
1.905
1.924
1.932
2.108
2.140
2.736
2.743
2.767
2.773
2.797
2.804
3.030
3.055
3.059
3.085
3.125
3.157
3.253
3.280
3.300
3.327
4.010
6.062
7.284
7.970
8.142
6.74
0.99
0.99
2.03
2.04
3.06
1.76
1.99
1.00
Current Data ParametersNAME SCH-90076EXPNO 10PROCNO 1
F2 - Acquisition ParametersDate_ 20161102Time 12.00INSTRUM spectPROBHD 5 mm PABBO BB-PULPROG zg30TD 65536SOLVENT CDCl3NS 16DS 2SWH 8012.820 HzFIDRES 0.122266 HzAQ 4.0894465 secRG 203DW 62.400 usecDE 6.50 usecTE 296.5 KD1 1.00000000 secTD0 1
======== CHANNEL f1 ========SFO1 400.1324710 MHzNUC1 1HP1 13.00 usecPLW1 19.00000000 W
F2 - Processing parametersSI 65536SF 400.1300000 MHzWDW noSSB 0LB 0 HzGB 0PC 1.00
PROTON CDCl3 D:\\ nmr1 29
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===================================================================== : zj : 4 : 1 : 34 : 2016-11-2 14:52:47 : 1 : 2.0 µl ! : 1.0 µl : C:\CHEM32\1\DATA\20161102\KR 2016-11-02 13-47-05\TEST-KR.M : 2016-11-2 14:30:18 : zj ( ) : C:\CHEM32\1\METHODS\TEST-KR.M : 2016-11-2 15:36:26 : zj ( )
min2.5 5 7.5 10 12.5 15 17.5 20
mAU
0
500
1000
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2000
DAD1 A, Sig=214,4 Ref=360,100 (20161102\KR 2016-11-02 13-47-05\SIG1000004.D) 5
.861
6.1
76
min2.5 5 7.5 10 12.5 15 17.5 20
mAU
0
200
400
600
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DAD1 B, Sig=254,16 Ref=360,100 (20161102\KR 2016-11-02 13-47-05\SIG1000004.D)
5.8
61 6
.176
8.0
64
===================================================================== ===================================================================== : : : 1.0000 : : 1.0000
1: DAD1 A, Sig=214,4 Ref=360,100 # [min] [min] [mAU*s] [mAU] %----|-------|----|-------|----------|----------|--------| 1 5.861 BV 0.0861 1.27386e4 2395.00684 99.2919 2 6.176 VBA 0.0491 90.85001 28.57674 0.7081
: C:\CHEM32\1\DATA\20161102\KR 2016-11-02 13-47-05\SIG1000004.D : SCH-90076
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: 1.28294e4 2423.58358 2: DAD1 B, Sig=254,16 Ref=360,100 # [min] [min] [mAU*s] [mAU] %----|-------|----|-------|----------|----------|--------| 1 5.861 BV 0.0790 7286.63672 1440.38660 99.0157 2 6.176 VB 0.0543 64.03655 17.66690 0.8702 3 8.064 BV 0.0669 8.39929 2.00232 0.1141 : 7359.07257 1460.05581 ===================================================================== *** ***
: C:\CHEM32\1\DATA\20161102\KR 2016-11-02 13-47-05\SIG1000004.D : SCH-90076
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File C:\CHEM32\1\DATA\20161102\20161017 2016-11-02 09-36-34\SIG10000012.D Injection Date : 2 Nov 16 11:52 am +0800 Tgt Mass(EZX) : Sample Name : SCH-90076 Location : 71 Acq. Operator : [BSB1] Inj : 1 Spec. Reported : MS Integration Inj Volume : 1 ul Acq. Method : C:\Chem32\1\DATA\20161102\20161017 2016-11-02 09-36-34\TEST KR POS_LC.M Analysis Method : C:\CHEM32\1\METHODS\TEST KR POS_LC.M Sample Info : Method Info :
min0 2 4 6 8
mAU
0250500750
100012501500
DAD1 A, Sig=254,4 Ref=off
3.23
9
3.51
7
min0 2 4 6 8
mAU
0
500
1000
1500
DAD1 C, Sig=214,4 Ref=off
3.24
0
3.52
1
min0 2 4 6 8
0
500000
1000000
1500000
2000000
MSD1 TIC, MS File ES-API, Pos, Scan, Frag: 70
3.41
3
3.74
7
Integration Results for DAD1 A, Sig=254,4 Ref=off
RetTim Width Area Height Area%|-------|--------|--------------|--------------|--------| 3.24 0.14 15969.93 1832.69 98.91 3.52 0.07 175.84 35.45 1.09
Integration Results for DAD1 C, Sig=214,4 Ref=off
RetTim Width Area Height Area%|-------|--------|--------------|--------------|--------| 3.24 0.17 18259.46 1738.55 98.55 3.52 0.07 269.15 51.52 1.45
Integration Results for MSD1 TIC, MS File
RetTim Width Area Height Area%|-------|--------|--------------|--------------|--------| 3.41 0.24 31670760.00 1988861.75 96.03 3.75 0.10 1310001.38 213339.94 3.97
LC/MS Report
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Ret. Time: 3.41 <<<< POSITIVE SPECTRA >>>>
m/z200 400 600 800 1000 1200 1400
0
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ES-API Positive
379
.1
189
.6
376
.1
Ret. Time: 3.75
m/z200 400 600 800 1000 1200
0
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20000
ES-API Positive
189
.4
396
.9 3
77.2
183
.1
376
.1 189
.6 1
88.7
LC/MS Report
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