SpectraBase Compound ID | DQSnuqEdQOr |
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InChI | InChI=1S/C11H10BrNO2/c1-7(12)6-13-10(14)8-4-2-3-5-9(8)11(13)15/h2-5,7H,6H2,1H3 |
InChIKey | OEDMJTQRHMQBHD-UHFFFAOYSA-N |
Mol Weight | 268.11 g/mol |
Molecular Formula | C11H10BrNO2 |
Exact Mass | 266.989492 g/mol |
SpectraBase Spectrum ID | 65Sd8K30W1Q |
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Name | Phthalimide, N-(2-bromopropyl)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 266.989491564 u |
Formula | C11H10BrNO2 |
InChI | InChI=1S/C11H10BrNO2/c1-7(12)6-13-10(14)8-4-2-3-5-9(8)11(13)15/h2-5,7H,6H2,1H3 |
InChIKey | OEDMJTQRHMQBHD-UHFFFAOYSA-N |
SMILES | C12=C(C=CC=C2)C(=O)N(C1=O)CC(Br)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939224 |