| SpectraBase Spectrum ID |
HPF0rsd1IrJ |
| Name |
1-((1R,3S)-1-(4-Methoxyphenyl)-5-methyl-4-oxaspiro[2.5]octa-5,7-dien-6-yl)ethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
270.125594437 u |
| Formula |
C17H18O3 |
| InChI |
InChI=1S/C17H18O3/c1-11(18)15-8-9-17(20-12(15)2)10-16(17)13-4-6-14(19-3)7-5-13/h4-9,16H,10H2,1-3H3/t16-,17-/m1/s1 |
| InChIKey |
CGFKNDUXAKWPFX-IAGOWNOFSA-N |
| SMILES |
[C@@]12(OC(C)=C(C=C2)C(=O)C)[C@@](C=2C=CC(=CC2)OC)(C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964091 |
![1-((1R,3S)-1-(4-methoxyphenyl)-5-methyl-4-oxaspiro[2.5]octa-5,7-dien-6-yl)ethanone](/api/spectrum/HPF0rsd1IrJ/structure.png?h=300&w=458 "1-((1R,3S)-1-(4-methoxyphenyl)-5-methyl-4-oxaspiro[2.5]octa-5,7-dien-6-yl)ethanone")
