SpectraBase Compound ID | FKNr3sB03a2 |
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InChI | InChI=1S/C16H33N3O2/c20-15-7-3-1-5-13(15)18-11-9-17-10-12-19-14-6-2-4-8-16(14)21/h13-21H,1-12H2 |
InChIKey | XHOYLQRZSOIESC-UHFFFAOYSA-N |
Mol Weight | 299.5 g/mol |
Molecular Formula | C16H33N3O2 |
Exact Mass | 299.257277 g/mol |
SpectraBase Spectrum ID | HzZmWg3bOeT |
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Name | bis[2-(2-Hydroxycyclohexylamino)ethyl]amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 299.257277313 u |
Formula | C16H33N3O2 |
InChI | InChI=1S/C16H33N3O2/c20-15-7-3-1-5-13(15)18-11-9-17-10-12-19-14-6-2-4-8-16(14)21/h13-21H,1-12H2 |
InChIKey | XHOYLQRZSOIESC-UHFFFAOYSA-N |
SMILES | C1(C(O)CCCC1)NCCNCCNC1C(O)CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94346 |