SpectraBase Compound ID | LJeKT2xI5k7 |
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InChI | InChI=1S/C10H12ClN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2 |
InChIKey | CIHHGGKKRPPWSU-UHFFFAOYSA-N |
Mol Weight | 181.67 g/mol |
Molecular Formula | C10H12ClN |
Exact Mass | 181.065827 g/mol |
SpectraBase Spectrum ID | 4B7j2I6KD2U |
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Name | 2-[p-Chlorophenyl]pyrolidine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 181.065827090 u |
Formula | C10H12ClN |
InChI | InChI=1S/C10H12ClN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2 |
InChIKey | CIHHGGKKRPPWSU-UHFFFAOYSA-N |
Molecular Weight | 181.666 g/mol |
SMILES | C1=C(C=CC(=C1)C1CCCN1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.911559 |