| SpectraBase Spectrum ID |
B7x8SMibxX6 |
| Name |
(Trans)-3-(diethoxymethyl)-2,6,6-trimethylbicyclo[3.1.1]heptane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.208930140 u |
| Formula |
C15H28O2 |
| InChI |
InChI=1S/C15H28O2/c1-6-16-14(17-7-2)12-8-11-9-13(10(12)3)15(11,4)5/h10-14H,6-9H2,1-5H3/t10-,11+,12+,13+/m0/s1 |
| InChIKey |
UVLMLUGKGYSTBW-UMSGYPCISA-N |
| Molecular Weight |
240.387 g/mol |
| SMILES |
C1[C@]([C@@]([C@]2(C[C@@]1(C2(C)C)[H])[H])(C)[H])(C(OCC)OCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943085 |
![(Trans)-3-(diethoxymethyl)-2,6,6-trimethylbicyclo[3.1.1]heptane](/api/spectrum/B7x8SMibxX6/structure.png?h=300&w=458 "(Trans)-3-(diethoxymethyl)-2,6,6-trimethylbicyclo[3.1.1]heptane")
