Hexanoic acid isopropyl ester
Compound with spectra: 2 NMR, 2 FTIR, 1 Raman, and 10 MS (GC)
| SpectraBase Compound ID | EDyr8EVcX0b |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-4-5-6-7-9(10)11-8(2)3/h8H,4-7H2,1-3H3 |
| InChIKey | JSHDAORXSNJOBA-UHFFFAOYSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C9H18O2 |
| Exact Mass | 158.13068 g/mol |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | W. W. Simons, Bio-Rad Laboratories, Sadtler Division, Philadelphia, Pennsylvania |
| Technique | CAPILLARY CELL: NEAT |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | W. W. Simons, Bio-Rad Laboratories, Sadtler Division, Philadelphia, Pennsylvania |
| Technique | CAPILLARY CELL: NEAT |
| Copyright | Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| Solvent | CDCl3; Reference=TMS; Temperature 297K |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Copyright | Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
|---|---|
| Source of Spectrum | Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SRH-2022-5304-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SRH-2022-6987-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AA-0-993-2 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | NP-1-8703-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | NP-17-3191-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | W5-0-0-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | LQ-1992-4045-0 |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
- Isopropyl hexanoate
- Isopropyl caproate
- Isopropyl hexylate
- Isopropyl capronate
- PROPYL ISO CAPRONATE
- PROPYL ISO HEXANOATE
- PROPYL ISO CAPROATE
- PROPYL ISO HEXYLATE
- Hexanoic acid, 1-methylethyl ester
- Propan-2-yl hexanoate
- iso-Propyl n-hexanoate
- 1-Methylethyl hexanoate
- n-Caproic acid isopropyl ester
- Hexanoic acid propan-2-yl ester
- N-C5H11C(O)OCH(CH3)2
- FEMA NO. 2950
- EINECS 219-000-9
- AI3-06020
Valeric acid isopropyl ester
Adipic acid, ethyl 2-propyl ester
9-Cyanononanoic acid, isopropyl ester
4-Hydroxybutanoic acid propan-2-yl ester
Ethyl hexanoate
(Sorbic acid)iron tricarbonyl, ethyl ester
Isopropyl 4-oxobutanoate
Methyl hexanoate
4-Pentenoic acid propan-2-yl ester
Isopropyl 3-cyanopropionate
This compound is available in the following databases:
KnowItAll GC-MS Library
Author: Wiley
The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.
Wiley Registry of Mass Spectral Data 2026
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.