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Bicyclo[4.2.0]octa-1,3,5-trien-7-ol, 3,4-dimethoxy-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Bicyclo[4.2.0]octa-1,3,5-trien-7-ol, 3,4-dimethoxy-
SpectraBase Compound ID 5Tpul4UT6h2
InChI InChI=1S/C10H12O3/c1-12-9-4-6-3-8(11)7(6)5-10(9)13-2/h4-5,8,11H,3H2,1-2H3
InChIKey NXTKPGCDJNXFCO-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6tmMYmC45rW
Name Bicyclo[4.2.0]octa-1,3,5-trien-7-ol, 3,4-dimethoxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 180.078644243 u
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-12-9-4-6-3-8(11)7(6)5-10(9)13-2/h4-5,8,11H,3H2,1-2H3
InChIKey NXTKPGCDJNXFCO-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES C1=2C(=CC(=C(C2)OC)OC)C(C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.965701