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Pentane, 1,3-dibromo-
SpectraBase Compound ID KVUPEosBKSE
InChI InChI=1S/C5H10Br2/c1-2-5(7)3-4-6/h5H,2-4H2,1H3
InChIKey SOZLNIPBRVQUOG-UHFFFAOYSA-N
Mol Weight 229.94 g/mol
Molecular Formula C5H10Br2
Exact Mass 227.914926 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4AqPZukliZt
Name Pentane, 1,3-dibromo-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 227.914926322 u
Formula C5H10Br2
InChI InChI=1S/C5H10Br2/c1-2-5(7)3-4-6/h5H,2-4H2,1H3
InChIKey SOZLNIPBRVQUOG-UHFFFAOYSA-N
Molecular Weight 229.943 g/mol
SMILES CCC(Br)CCBr
Spectrum/Structure Validation Score (Vapor Phase IR) 0.833633