SpectraBase Compound ID | 7dQP4TjjyWK |
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InChI | InChI=1S/C13H24/c1-9(2)10-11(3,4)13(7,8)12(10,5)6/h1-8H3 |
InChIKey | ABBZGFLISGWIFD-UHFFFAOYSA-N |
Mol Weight | 180.33 g/mol |
Molecular Formula | C13H24 |
Exact Mass | 180.187801 g/mol |
SpectraBase Spectrum ID | 424CcNaZ3n8 |
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Name | Cyclobutane, hexamethyl(1-methylethylidene)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 180.187800773 u |
Formula | C13H24 |
InChI | InChI=1S/C13H24/c1-9(2)10-11(3,4)13(7,8)12(10,5)6/h1-8H3 |
InChIKey | ABBZGFLISGWIFD-UHFFFAOYSA-N |
Molecular Weight | 180.335 g/mol |
SMILES | C1(C(C)(C)C(C1(C)C)(C)C)=C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946633 |