SpectraBase Compound ID | I6un1ARqRnO |
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InChI | InChI=1S/C12H13N.ClH/c1-8-7-9(2)12(13)11-6-4-3-5-10(8)11;/h3-7H,13H2,1-2H3;1H |
InChIKey | XQNZJEGBDWRLNT-UHFFFAOYSA-N |
Mol Weight | 207.7 g/mol |
Molecular Formula | C12H14ClN |
Exact Mass | 207.081477 g/mol |
SpectraBase Spectrum ID | G2Cg1q9l3r4 |
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Name | 1-Naphthalenamine, 2,4-dimethyl-, hydrochloride, salt |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 207.081477155 u |
Formula | C12H14ClN |
InChI | InChI=1S/C12H13N.ClH/c1-8-7-9(2)12(13)11-6-4-3-5-10(8)11;/h3-7H,13H2,1-2H3;1H |
InChIKey | XQNZJEGBDWRLNT-UHFFFAOYSA-N |
SMILES | [NH3+]C1=C(C=C(C=2C=CC=CC12)C)C.[Cl-] |
Spectrum/Structure Validation Score (Raman) | 0.917803 |