| SpectraBase Spectrum ID |
5MS7QJJPUL3 |
| Name |
Heptan-4-ol <2,6-dimethyl-> |
| Source of Sample |
SAFC Cat.no. 541486 |
| CAS Registry Number |
108-82-7 |
| 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 |
144.151415263 u |
| Formula |
C9H20O |
| InChI |
InChI=1S/C9H20O/c1-7(2)5-9(10)6-8(3)4/h7-10H,5-6H2,1-4H3 |
| InChIKey |
HXQPUEQDBSPXTE-UHFFFAOYSA-N |
| Molecular Weight |
144.258 g/mol |
| Number of Peaks |
50 |
| RI1 |
1000 |
| RI2 |
670 |
| RI3 |
763 |
| RI4 |
720 |
| SMILES |
OC(CC(C)C)CC(C)C |
| SPLASH |
splash10-014l-9000000000-3753c0a29ea65ec0b40e |
| 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 |
4-Heptanol, 2,6-dimethyl- |
| Wiley ID |
LM_FFNSC3_322 |
