SpectraBase Compound ID | EMF0Y1FxBm0 |
---|---|
InChI | InChI=1S/C11H12/c1-9-7-11(8-9)10-5-3-2-4-6-10/h2-6,11H,1,7-8H2 |
InChIKey | IDNRIYVQXZTTIF-UHFFFAOYSA-N |
Mol Weight | 144.22 g/mol |
Molecular Formula | C11H12 |
Exact Mass | 144.0939 g/mol |
SpectraBase Spectrum ID | ItKW2wwADVQ |
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Name | (3-Methylenecyclobutyl)benzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 144.093900386 u |
Formula | C11H12 |
InChI | InChI=1S/C11H12/c1-9-7-11(8-9)10-5-3-2-4-6-10/h2-6,11H,1,7-8H2 |
InChIKey | IDNRIYVQXZTTIF-UHFFFAOYSA-N |
Molecular Weight | 144.217 g/mol |
SMILES | C1(CC(C1)C1=CC=CC=C1)=C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.980704 |