| SpectraBase Spectrum ID |
LDqvcMEfGUS |
| Name |
(1S,4S,5R)-(+)-3-THUJANONE |
| Source of Sample |
J. C. Rees, D. Whittaker Org. Magn. Resonance 15, 363(1981) |
| Copyright |
Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H16O |
| InChI |
InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8+,10-/m0/s1 |
| InChIKey |
USMNOWBWPHYOEA-XKSSXDPKSA-N |
| Molecular Weight |
152.24 |
| Solvent |
Chloroform-d; Reference=TMS; Temperature=300 K Spectrometer= Varian XL-100 |
| Synonyms |
3-THUJANONE, /1S,4S,5R/-/plus/-,
B-THUJONE
BICYCLO/3.1.0/HEXAN-3-ONE, 1-ISOPROPYL-4-METHYL-, |
