SpectraBase Compound ID | Dc3q6UT0hKB |
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InChI | InChI=1S/C10H13N/c1-8-7-11(2)10-6-4-3-5-9(8)10/h3-6,8H,7H2,1-2H3 |
InChIKey | MNNJPINCYKGTNO-UHFFFAOYSA-N |
Mol Weight | 147.22 g/mol |
Molecular Formula | C10H13N |
Exact Mass | 147.104799 g/mol |
SpectraBase Spectrum ID | HavKxxgVqdW |
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Name | 1,3-Dimethyl-2,3-dihydroindole |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 147.104799423 u |
Formula | C10H13N |
InChI | InChI=1S/C10H13N/c1-8-7-11(2)10-6-4-3-5-9(8)10/h3-6,8H,7H2,1-2H3 |
InChIKey | MNNJPINCYKGTNO-UHFFFAOYSA-N |
Molecular Weight | 147.221 g/mol |
SMILES | C1N(C=2C=CC=CC2C1C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930976 |