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3-Methyl-2-(3-methylbut-2-enyl)butane-1,3-diol
SpectraBase Compound ID D5Btzozbv03
InChI InChI=1S/C10H20O2/c1-8(2)5-6-9(7-11)10(3,4)12/h5,9,11-12H,6-7H2,1-4H3
InChIKey QMOAXOFWWFUAKB-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8hz1Ua5difi
Name 3-Methyl-2-(3-methylbut-2-enyl)butane-1,3-diol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.146329882 u
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-8(2)5-6-9(7-11)10(3,4)12/h5,9,11-12H,6-7H2,1-4H3
InChIKey QMOAXOFWWFUAKB-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES C(C(CC=C(C)C)CO)(O)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.982415