| SpectraBase Spectrum ID |
9Bk48LjV9QJ |
| Name |
(1R,2S,3R,4S)-1,7,7-Trimethyl-2-neopentyloxy-3-[(E)-prop-1-enoxy]norbornane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
280.240230268 u |
| Formula |
C18H32O2 |
| InChI |
InChI=1S/C18H32O2/c1-8-11-19-14-13-9-10-18(7,17(13,5)6)15(14)20-12-16(2,3)4/h8,11,13-15H,9-10,12H2,1-7H3/b11-8+/t13-,14-,15-,18+/m1/s1 |
| InChIKey |
UODZKNOJDFUMFV-IAIFKNKMSA-N |
| SMILES |
[C@]12(C([C@]([H])(CC2)[C@]([C@]1(OCC(C)(C)C)[H])(O\C=C\C)[H])(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965062 |
![(1R,2S,3R,4S)-1,7,7-trimethyl-2-neopentyloxy-3-[(E)-prop-1-enoxy]norbornane](/api/spectrum/9Bk48LjV9QJ/structure.png?h=300&w=458 "(1R,2S,3R,4S)-1,7,7-trimethyl-2-neopentyloxy-3-[(E)-prop-1-enoxy]norbornane")
