SpectraBase Spectrum ID |
KXHvr4ZPQMJ |
Name |
1,4-Epoxynaphthalene, 6,7-dibromo-1,4-dihydro-5-methoxy-1,4,8-trimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
371.936055689 u |
Formula |
C14H14Br2O2 |
InChI |
InChI=1S/C14H14Br2O2/c1-7-8-9(12(17-4)11(16)10(7)15)14(3)6-5-13(8,2)18-14/h5-6H,1-4H3 |
InChIKey |
QEXOPMVYGHTVNZ-UHFFFAOYSA-N |
Molecular Weight |
374.072 g/mol |
SMILES |
C12=C(C3(C)OC2(C=C3)C)C(C)=C(C(=C1OC)Br)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911986 |