SpectraBase Compound ID | F9psdqyECs7 |
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InChI | InChI=1S/C9H13NO.ClH/c1-7(10)8-3-5-9(11-2)6-4-8;/h3-7H,10H2,1-2H3;1H |
InChIKey | FYLBCUWOAFIYOW-UHFFFAOYSA-N |
Mol Weight | 187.67 g/mol |
Molecular Formula | C9H14ClNO |
Exact Mass | 187.076392 g/mol |
SpectraBase Spectrum ID | IVzbJxCZXQc |
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Name | p-Methoxy-alpha-methylbenzylamine, hydrochloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 187.076391774 u |
Formula | C9H14ClNO |
InChI | InChI=1S/C9H13NO.ClH/c1-7(10)8-3-5-9(11-2)6-4-8;/h3-7H,10H2,1-2H3;1H |
InChIKey | FYLBCUWOAFIYOW-UHFFFAOYSA-N |
Molecular Weight | 187.670 g/mol |
SMILES | Cl.NC(C=1C=CC(=CC1)OC)C |
Spectrum/Structure Validation Score (Raman) | 0.958655 |