SpectraBase Compound ID | 7ZGLZ9PN6A3 |
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InChI | InChI=1S/C16H29BrO4/c1-14(2)13-21-16(19)10-9-15(18)20-12-8-6-4-3-5-7-11-17/h14H,3-13H2,1-2H3 |
InChIKey | ZUIFKCRYLRMLPM-UHFFFAOYSA-N |
Mol Weight | 365.31 g/mol |
Molecular Formula | C16H29BrO4 |
Exact Mass | 364.124922 g/mol |
SpectraBase Spectrum ID | KC2sJHAYhRo |
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Name | Succinic acid, 8-bromooctyl isobutyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 364.124922410 u |
Formula | C16H29BrO4 |
InChI | InChI=1S/C16H29BrO4/c1-14(2)13-21-16(19)10-9-15(18)20-12-8-6-4-3-5-7-11-17/h14H,3-13H2,1-2H3 |
InChIKey | ZUIFKCRYLRMLPM-UHFFFAOYSA-N |
Molecular Weight | 365.308 g/mol |
SMILES | C(CCC(OCCCCCCCCBr)=O)(OCC(C)C)=O |