SpectraBase Compound ID | 7FJJWAoJcjG |
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InChI | InChI=1S/C22H38N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-22(25)24-21-17-15-16-20(23)19-21/h15-17,19H,2-14,18,23H2,1H3,(H,24,25) |
InChIKey | URRCJEJRVAKFLX-UHFFFAOYSA-N |
Mol Weight | 346.6 g/mol |
Molecular Formula | C22H38N2O |
Exact Mass | 346.298414 g/mol |
SpectraBase Spectrum ID | By0bhjGG47 |
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Name | 3'-Aminohexadecananilide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 346.298413851 u |
Formula | C22H38N2O |
InChI | InChI=1S/C22H38N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-22(25)24-21-17-15-16-20(23)19-21/h15-17,19H,2-14,18,23H2,1H3,(H,24,25) |
InChIKey | URRCJEJRVAKFLX-UHFFFAOYSA-N |
Molecular Weight | 346.559 g/mol |
SMILES | NC=1C=CC=C(C1)NC(CCCCCCCCCCCCCCC)=O |
Spectrum/Structure Validation Score (Raman) | 0.981474 |