SpectraBase Compound ID | EMXQL1synZv |
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InChI | InChI=1S/C10H14ClNO/c1-2-12(7-8-13)10-5-3-9(11)4-6-10/h3-6,13H,2,7-8H2,1H3 |
InChIKey | SXUDKXLWTFUESA-UHFFFAOYSA-N |
Mol Weight | 199.68 g/mol |
Molecular Formula | C10H14ClNO |
Exact Mass | 199.076392 g/mol |
SpectraBase Spectrum ID | J6rpww64rpd |
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Name | p-Chloro-N-ethyl-N-hydroxy-ethylaniline |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 199.076391774 u |
Formula | C10H14ClNO |
InChI | InChI=1S/C10H14ClNO/c1-2-12(7-8-13)10-5-3-9(11)4-6-10/h3-6,13H,2,7-8H2,1H3 |
InChIKey | SXUDKXLWTFUESA-UHFFFAOYSA-N |
Molecular Weight | 199.681 g/mol |
SMILES | C=1(N(CCO)CC)C=CC(=CC1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.895156 |