| SpectraBase Spectrum ID |
CD4aFI3Gw3z |
| Name |
Heptanol |
| Source of Sample |
SAFC Cat.no. W254800 |
| CAS Registry Number |
111-70-6 |
| 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 |
116.120115134 u |
| Formula |
C7H16O |
| InChI |
InChI=1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3 |
| InChIKey |
BBMCTIGTTCKYKF-UHFFFAOYSA-N |
| Molecular Weight |
116.204 g/mol |
| Number of Peaks |
44 |
| RI1 |
970 |
| RI2 |
643 |
| RI3 |
894 |
| RI4 |
849 |
| SMILES |
OCCCCCCC |
| SPLASH |
splash10-0596-9000000000-4b0968c8f209e2986238 |
| 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 |
1-Heptanol |
| Wiley ID |
LM_FFNSC3_346 |
