SpectraBase Spectrum ID |
4kqb21TuEl7 |
Name |
6-[2-(Benzyloxy)-ethyl]-7,7-dimethyl-1,4-dioxaspiro-[4,5]-decane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
304.203844759 u |
Formula |
C19H28O3 |
InChI |
InChI=1S/C19H28O3/c1-18(2)10-6-11-19(21-13-14-22-19)17(18)9-12-20-15-16-7-4-3-5-8-16/h3-5,7-8,17H,6,9-15H2,1-2H3 |
InChIKey |
LUSMUKZMFSDFBZ-UHFFFAOYSA-N |
Molecular Weight |
304.430 g/mol |
SMILES |
C1OC2(OC1)C(C(CCC2)(C)C)CCOCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850311 |