SpectraBase Compound ID | 70IkDmKxfhO |
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InChI | InChI=1S/C9H13NO/c1-10-7-6-8-2-4-9(11)5-3-8/h2-5,10-11H,6-7H2,1H3 |
InChIKey | AXVZFRBSCNEKPQ-UHFFFAOYSA-N |
Mol Weight | 151.21 g/mol |
Molecular Formula | C9H13NO |
Exact Mass | 151.099714 g/mol |
SpectraBase Spectrum ID | FLAYUKgj1GY |
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Name | N-Methyltyramine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 151.099714042 u |
Formula | C9H13NO |
InChI | InChI=1S/C9H13NO/c1-10-7-6-8-2-4-9(11)5-3-8/h2-5,10-11H,6-7H2,1H3 |
InChIKey | AXVZFRBSCNEKPQ-UHFFFAOYSA-N |
Molecular Weight | 151.209 g/mol |
SMILES | C1(O)=CC=C(CCNC)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.960776 |