SpectraBase Spectrum ID |
xMqRjRrhdW |
Name |
4,11-Dimethoxy-5,10-dioxa-6,6-tetramethylene-9,9-tetramethylenetricyclo[6.3.0.0(3,7)]undecane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
322.214409442 u |
Formula |
C19H30O4 |
InChI |
InChI=1S/C19H30O4/c1-20-16-12-11-13-15(14(12)18(22-16)7-3-4-8-18)19(9-5-6-10-19)23-17(13)21-2/h12-17H,3-11H2,1-2H3 |
InChIKey |
IUMKSUZKLKMRSQ-UHFFFAOYSA-N |
Molecular Weight |
322.445 g/mol |
SMILES |
C12C3C(C(OC)OC33CCCC3)CC2C(OC)OC11CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.831804 |