| SpectraBase Compound ID | HljeEyXcEXC |
|---|---|
| InChI | InChI=1S/C7H8BrNO2/c1-3-5(4(2)8)7(11)9-6(3)10/h4H,1-2H3,(H,9,10,11) |
| InChIKey | XPSIILZCPAXYRE-UHFFFAOYSA-N |
| Mol Weight | 218.05 g/mol |
| Molecular Formula | C7H8BrNO2 |
| Exact Mass | 216.973841 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5gPGW3btc0N |
|---|---|
| Name | XPSIILZCPAXYRE-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H8BrNO2 |
| InChI | InChI=1S/C7H8BrNO2/c1-3-5(4(2)8)7(11)9-6(3)10/h4H,1-2H3,(H,9,10,11) |
| InChIKey | XPSIILZCPAXYRE-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 218.050 g/mol |
| Source File Reference | MHKO8283 |