SpectraBase Compound ID | 9vRMy2UCZ4y |
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InChI | InChI=1S/C14H22/c1-3-4-5-6-7-11-14-12-9-8-10-13(14)2/h8-10,12H,3-7,11H2,1-2H3 |
InChIKey | YGDQXQVHCOFEEP-UHFFFAOYSA-N |
Mol Weight | 190.33 g/mol |
Molecular Formula | C14H22 |
Exact Mass | 190.172151 g/mol |
SpectraBase Spectrum ID | ARVz40b1zZu |
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Name | 1-Heptyl-2-methylbenzene |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.172150708 u |
Formula | C14H22 |
InChI | InChI=1S/C14H22/c1-3-4-5-6-7-11-14-12-9-8-10-13(14)2/h8-10,12H,3-7,11H2,1-2H3 |
InChIKey | YGDQXQVHCOFEEP-UHFFFAOYSA-N |
Molecular Weight | 190.330 g/mol |
SMILES | C(CCCCC)Cc1ccccc1C |