SpectraBase Compound ID | J2ozF867BJE |
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InChI | InChI=1S/C12H19Br/c13-12-8-2-6-11(12,7-3-9-12)10-4-1-5-10/h10H,1-9H2 |
InChIKey | ZSFOPCWWEPQBDK-UHFFFAOYSA-N |
Mol Weight | 243.19 g/mol |
Molecular Formula | C12H19Br |
Exact Mass | 242.067014 g/mol |
SpectraBase Spectrum ID | jAzJLm1F0r |
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Name | 3a-Bromo-6a-cyclobutyloctahydropentalene |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H19Br |
InChI | InChI=1S/C12H19Br/c13-12-8-2-6-11(12,7-3-9-12)10-4-1-5-10/h10H,1-9H2 |
InChIKey | ZSFOPCWWEPQBDK-UHFFFAOYSA-N |
Molecular Weight | 243.188 g/mol |
SMILES | C12(C(Br)(CCC2)CCC1)C1CCC1 |
SPLASH | splash10-03di-0900000000-22ad185c13132ec3ca7d |
Source of Spectrum | F-55-3911-18 |
Wiley ID | 837293 |