| SpectraBase Spectrum ID |
IuRCeEA9paB |
| Name |
Heptan-2-ol <6-methyl-> |
| CAS Registry Number |
4730-22-7 |
| 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 |
130.135765199 u |
| Formula |
C8H18O |
| InChI |
InChI=1S/C8H18O/c1-7(2)5-4-6-8(3)9/h7-9H,4-6H2,1-3H3 |
| InChIKey |
FCOUHTHQYOMLJT-UHFFFAOYSA-N |
| Molecular Weight |
130.231 g/mol |
| Number of Peaks |
35 |
| RI1 |
960 |
| SMILES |
OC(CCCC(C)C)C |
| SPLASH |
splash10-0005-9000000000-29f30ad72870f677e838 |
| 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-Heptanol, 6-methyl- |
| Wiley ID |
LM_FFNSC3_2953 |
