| SpectraBase Spectrum ID |
Kp73GsC46Vy |
| Name |
trans-Doremox |
| CAS Registry Number |
476688-28-5 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
176.120115134 u |
| Formula |
C12H16O |
| InChI |
InChI=1S/C12H16O/c1-10-7-8-13-12(9-10)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-,12-/m1/s1 |
| InChIKey |
GDAVABNCFOTAOD-ZYHUDNBSSA-N |
| Molecular Weight |
176.259 g/mol |
| Number of Peaks |
50 |
| RI1 |
1417 |
| RI2 |
1097 |
| RI3 |
1268 |
| RI4 |
1227 |
| RI5 |
1391 |
| SMILES |
C[C@]1(C[C@@](OCC1)(c1ccccc1)[H])[H] |
| SPLASH |
splash10-056r-7900000000-57f4b3663c4ff73338ba |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2H-Pyran, tetrahydro-4-methyl-2-phenyl-, (2R,4R)- |
| Wiley ID |
LM_FFNSC3_3223 |
