SpectraBase Compound ID | Adyh8lWpZ93 |
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InChI | InChI=1S/C12H16/c1-2-5-10-8-9-11-6-3-4-7-12(10)11/h3-4,6-7,10H,2,5,8-9H2,1H3 |
InChIKey | DYCGOFGOWDKOKT-UHFFFAOYSA-N |
Mol Weight | 160.26 g/mol |
Molecular Formula | C12H16 |
Exact Mass | 160.125201 g/mol |
SpectraBase Spectrum ID | CSFvJFrUTL5 |
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Name | 1-Propyl-2,3-dihydro-1H-indene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 160.125200515 u |
Formula | C12H16 |
InChI | InChI=1S/C12H16/c1-2-5-10-8-9-11-6-3-4-7-12(10)11/h3-4,6-7,10H,2,5,8-9H2,1H3 |
InChIKey | DYCGOFGOWDKOKT-UHFFFAOYSA-N |
Molecular Weight | 160.260 g/mol |
SMILES | CCCC1C=2C=CC=CC2CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951124 |