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4-Tert-butyl-2-chloranyl-1-(3-chloranyl-2-methyl-propoxy)benzene
SpectraBase Compound ID 6xW6GcBr3w6
InChI InChI=1S/C14H20Cl2O/c1-10(8-15)9-17-13-6-5-11(7-12(13)16)14(2,3)4/h5-7,10H,8-9H2,1-4H3
InChIKey RNPSFHXWYYVTOL-UHFFFAOYSA-N
Mol Weight 275.22 g/mol
Molecular Formula C14H20Cl2O
Exact Mass 274.089121 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1KFMRMjSeM
Name 4-Tert-butyl-2-chloranyl-1-(3-chloranyl-2-methyl-propoxy)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.089120663 u
Formula C14H20Cl2O
InChI InChI=1S/C14H20Cl2O/c1-10(8-15)9-17-13-6-5-11(7-12(13)16)14(2,3)4/h5-7,10H,8-9H2,1-4H3
InChIKey RNPSFHXWYYVTOL-UHFFFAOYSA-N
SMILES C=1(C=C(Cl)C(=CC1)OCC(CCl)C)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.95996