| SpectraBase Spectrum ID |
Dfs1dwOUZIU |
| Name |
(7-exo-(Diethylamino)-2-exo-(4-methoxyphenyl) 3-oxabicyclo[3.2.0]heptan-6-endo-yl)methano |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.199093730 u |
| Formula |
C18H27NO3 |
| InChI |
InChI=1S/C18H27NO3/c1-4-19(5-2)17-14(10-20)15-11-22-18(16(15)17)12-6-8-13(21-3)9-7-12/h6-9,14-18,20H,4-5,10-11H2,1-3H3/t14-,15?,16?,17+,18+/m1/s1 |
| InChIKey |
ACASWIAWNOTTBK-UIJHXXCUSA-N |
| SMILES |
[C@]1(C2[C@]([C@@](C2CO1)(CO)[H])(N(CC)CC)[H])(C1=CC=C(C=C1)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964151 |
![(7-exo-(Diethylamino)-2-exo-(4-methoxyphenyl) 3-oxabicyclo[3.2.0]heptan-6-endo-yl)methano](/api/spectrum/Dfs1dwOUZIU/structure.png?h=300&w=458 "(7-exo-(Diethylamino)-2-exo-(4-methoxyphenyl) 3-oxabicyclo[3.2.0]heptan-6-endo-yl)methano")
