SpectraBase Compound ID | gkPp8DMwc5 |
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InChI | InChI=1S/C14H10O/c1-9(15)12-8-7-11-6-5-10-3-2-4-13(12)14(10)11/h2-8H,1H3 |
InChIKey | IBCPQVVZSWTLEG-UHFFFAOYSA-N |
Mol Weight | 194.23 g/mol |
Molecular Formula | C14H10O |
Exact Mass | 194.073165 g/mol |
SpectraBase Spectrum ID | 5J0QYSsgeNt |
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Name | 5-Acetoacenaphthylene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 194.073164941 u |
Formula | C14H10O |
InChI | InChI=1S/C14H10O/c1-9(15)12-8-7-11-6-5-10-3-2-4-13(12)14(10)11/h2-8H,1H3 |
InChIKey | IBCPQVVZSWTLEG-UHFFFAOYSA-N |
Molecular Weight | 194.233 g/mol |
SMILES | C1=CC=2C=CC=3C2C(=C1)C(=CC3)C(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.859597 |