| SpectraBase Spectrum ID |
7Qgev1u723W |
| Name |
1-Octen-3-ol butanoate |
| CAS Registry Number |
16491-54-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C12H22O2/c1-4-7-8-10-11(6-3)14-12(13)9-5-2/h6,11H,3-5,7-10H2,1-2H3 |
| InChIKey |
LZWFXVJBIZIHCH-UHFFFAOYSA-N |
| Molecular Weight |
198.306 g/mol |
| SMILES |
C(OC(CCC)=O)(CCCCC)C=C |
| SPLASH |
splash10-00dl-9100000000-c853f3cb15761a81e0bc |
| Source |
ex BEDOUKIAN RES. |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Octen-3-ol butanoate<1-> |
| Wiley ID |
1887746 |
