| SpectraBase Spectrum ID |
CjvS0vRMAiv |
| Name |
1-Phenanthreneacetaldehyde, 1,4,4A,4B,5,6,7,8,8A,9,10,10A-dodecahydro-2,4B,8,8,10A-pentamethyl-, [1S-(1.alpha.,4A.beta.,4B.alpha.,8A.beta.,10A.alpha.)]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.260965714 u |
| Formula |
C21H34O |
| InChI |
InChI=1S/C21H34O/c1-15-7-8-18-20(4,16(15)10-14-22)13-9-17-19(2,3)11-6-12-21(17,18)5/h7,14,16-18H,6,8-13H2,1-5H3/t16-,17+,18+,20+,21+/m0/s1 |
| InChIKey |
FDFBNXUMZLHYDZ-QOLKULSZSA-N |
| SMILES |
[C@@]12([C@]([C@@]3(CCCC([C@]3(CC2)[H])(C)C)C)(CC=C([C@@]1(CC=O)[H])C)[H])C |
![1-Phenanthreneacetaldehyde, 1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydro-2,4b,8,8,10a-pentamethyl-, [1S-(1.alpha.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]-](/api/spectrum/CjvS0vRMAiv/structure.png?h=300&w=458 "1-Phenanthreneacetaldehyde, 1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydro-2,4b,8,8,10a-pentamethyl-, [1S-(1.alpha.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]-")
