SpectraBase Compound ID | 5mLYAxQEDnj |
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InChI | InChI=1S/C33H48N6O9/c1-4-25-46-28(40)34-19-13-7-10-16-22-37-31(43)38(23-17-11-8-14-20-35-29(41)47-26-5-2)33(45)39(32(37)44)24-18-12-9-15-21-36-30(42)48-27-6-3/h1-3H,7-27H2,(H,34,40)(H,35,41)(H,36,42) |
InChIKey | JEBLBIGOXBMBNT-UHFFFAOYSA-N |
Mol Weight | 672.8 g/mol |
Molecular Formula | C33H48N6O9 |
Exact Mass | 672.348277 g/mol |
SpectraBase Spectrum ID | ItzAXQkCzUr |
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Name | Tolonate tris propargyl |
CAS Registry Number | 387859-60-1 |
Comments | Atmospheric correction |
Compound Type | Pure |
Copyright | Copyright © 2013-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Detector Name | LiTa03 |
Formula | C33H48N6O9 |
InChI | InChI=1S/C33H48N6O9/c1-4-25-46-28(40)34-19-13-7-10-16-22-37-31(43)38(23-17-11-8-14-20-35-29(41)47-26-5-2)33(45)39(32(37)44)24-18-12-9-15-21-36-30(42)48-27-6-3/h1-3H,7-27H2,(H,34,40)(H,35,41)(H,36,42) |
InChIKey | JEBLBIGOXBMBNT-UHFFFAOYSA-N |
Instrument Name | PerkinElmer SpectrumTwo |
Sample Description | viscous |
Technique | ATR-IR |