| SpectraBase Spectrum ID |
CmzeKmR8hkV |
| Name |
(4R,5S)-4-Isopropylspiro[4.4]nonane-1,7-dione |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O2 |
| InChI |
InChI=1S/C12H18O2/c1-8(2)10-3-4-11(14)12(10)6-5-9(13)7-12/h8,10H,3-7H2,1-2H3/t10-,12+/m1/s1 |
| InChIKey |
JCXRKEAFUMLNSD-PWSUYJOCSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.1c02627 |
| Molecular Weight |
194.274 g/mol |
| Optical Rotation |
[a]D25 = +15.2 (c = 1.00, CDCl3) |
| Reported Formula |
C12H18O2 |
| SMILES |
C1CC(C[C@@]11C(CC[C@@]1(C(C)C)[H])=O)=O |
| SPLASH |
splash10-00xs-7900000000-af67c2b7b6eda06a34a2 |
| Source of Spectrum |
JOC-87-648-4a |
| Wiley ID |
1884197 |
![(4R,5S)-4-Isopropylspiro[4.4]nonane-1,7-dione](/api/spectrum/CmzeKmR8hkV/structure.png?h=300&w=458 "(4R,5S)-4-Isopropylspiro[4.4]nonane-1,7-dione")
