SpectraBase Spectrum ID |
GSljJHV6uJ9 |
Name |
Pamabrom |
Source of Sample |
TCI Chemicals India Pvt. Ltd. |
Catalog Number |
P2359 |
Lot Number |
RVNKK-LI |
Accessory |
DuraSample IR #145404C7 |
Acquisition Mode |
double sided, forward-backward |
Actual Signal Gain |
16 |
Actual Signal Gain 2nd Channel |
1 |
Additional Data Treatment |
1 |
Analog Signal 1 |
0.270426 |
Analog Signal 2 |
0 |
Aperture Setting |
6 mm |
Apodization Function |
Norton-Beer, medium |
Background Measurement Channel |
Sample Compartment |
Background Peak Amplitude 2nd Channel |
1 |
Background Peak Location 2nd Channel |
1 |
Background Rotations |
32 |
Background Scans |
32 |
Background Scans or Time |
Scans |
Backward Peak Amplitude |
-1670 |
Backward Peak Location |
7370 |
Beam Splitter Setting |
KBr |
CAS Registry Number |
606-04-2 |
Color Properties |
White |
Container ID |
C-009674 |
Copyright |
Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Data Point Format |
1 |
Delay Before Measurement |
1 s |
Detector Setting |
RT-DLaTGS [Internal] |
End Frequency Limit for File |
340 |
External Synchronization |
Off |
Focal Length |
100 |
Formula |
C11H18BrN5O3 |
Frequency of First Point |
3998.34 cm⁻¹ |
Frequency of Last Point |
339.463 cm⁻¹ |
High Folding Limit |
15800.5 |
High Frequency Limit |
8000 cm⁻¹ |
High Pass Filter |
0 |
InChI |
InChI=1S/C7H7BrN4O2.C4H11NO/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-4(2,5)3-6/h1-2H3,(H,9,10);6H,3,5H2,1-2H3 |
InChIKey |
ATOTUUBRFJHZQG-UHFFFAOYSA-N |
Instrument Name |
Bruker Tensor 27 FT-IR |
Laser Wavenumber |
15800.5 cm⁻¹ |
Low Folding Limit |
0 |
Low Frequency Limit |
0 |
Low Pass Filter |
10 |
Measurement Channel |
Sample Compartment |
Molecular Weight |
348.201 g/mol |
Non Linearity Correction |
0 |
Number of Points |
3795 |
Number of Sample Scans |
32 |
Optical Filter Setting |
Open |
Peak Amplitude |
-1676 |
Peak Amplitude 2nd Channel |
1 |
Peak Location |
7366 |
Peak Location 2nd Channel |
1 |
Phase Correction Mode |
Mertz |
Phase Resolution |
8 |
Physical State |
Solid |
Preamplifier Gain |
3 |
Preamplifier Gain Background |
0 |
Purity |
98% |
Relative Humidity Interferometer |
20 % |
Resolution |
4 |
SKU |
P2359-1G |
SMILES |
NC(CO)(C)C.[nH]1c2N(C(N(C(c2nc1Br)=O)C)=O)C |
Sample Comments |
Sample ground at metal edge of ATR |
Sample Rotations |
32 |
Sample Scans or Time |
Scans |
Sample Spacing Divisor |
1 |
Sample Spacing Multiplicator |
1 |
Scan Time |
27.293 s |
Scanner Temperature |
28.1 °C |
Scanner Velocity |
10 kHz |
Signal Gain, Background |
automatic |
Signal Gain, Sample |
automatic |
Source of Spectrum |
Bio-Rad Laboratories, Inc. |
Start Frequency Limit for File |
4000 cm⁻¹ |
Synonyms |
8-Bromotheophylline 2-amino-2-methyl-1-propanol |
Technique |
ATR-Neat |
Zero Filling Factor |
4 |