| SpectraBase Spectrum ID |
FXT9yPpmM5n |
| Name |
Pinacol |
| Source of Sample |
SAFC Cat.no. 221171 |
| CAS Registry Number |
76-09-5 |
| 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 |
118.099379689 u |
| Formula |
C6H14O2 |
| InChI |
InChI=1S/C6H14O2/c1-5(2,7)6(3,4)8/h7-8H,1-4H3 |
| InChIKey |
IVDFJHOHABJVEH-UHFFFAOYSA-N |
| Molecular Weight |
118.176 g/mol |
| Number of Peaks |
32 |
| RI1 |
858 |
| RI2 |
519 |
| RI3 |
889 |
| RI4 |
844 |
| SMILES |
OC(C(C)(O)C)(C)C |
| SPLASH |
splash10-0a4i-9000000000-adbe1054fab9f55c18ec |
| 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 |
2,3-Butanediol, 2,3-dimethyl- |
| Wiley ID |
LM_FFNSC3_411 |
