SpectraBase Compound ID | 9nj0SwsdjBa |
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InChI | InChI=1S/C12H17N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2 |
InChIKey | TXTHKGMZDDTZFD-UHFFFAOYSA-N |
Mol Weight | 175.27 g/mol |
Molecular Formula | C12H17N |
Exact Mass | 175.1361 g/mol |
SpectraBase Spectrum ID | IeVIR3asuCv |
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Name | N-Cyclohexylaniline |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 175.136099551 u |
Formula | C12H17N |
InChI | InChI=1S/C12H17N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2 |
InChIKey | TXTHKGMZDDTZFD-UHFFFAOYSA-N |
Molecular Weight | 175.275 g/mol |
SMILES | N(C1=CC=CC=C1)C1CCCCC1 |
Spectrum/Structure Validation Score (Raman) | 0.732199 |