3-Pentylchloride
Compound with spectra: 7 NMR, 1 FTIR, and 3 MS (GC)
| SpectraBase Compound ID | BFWJLHW5YxO |
|---|---|
| InChI | InChI=1S/C5H11Cl/c1-3-5(6)4-2/h5H,3-4H2,1-2H3 |
| InChIKey | CXQSCYIVCSCSES-UHFFFAOYSA-N |
| Mol Weight | 106.6 g/mol |
| Molecular Formula | C5H11Cl |
| Exact Mass | 106.054928 g/mol |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | A. Ejchart Org. Magn. Resonance 15, 22 (1981) |
| Solvent | Chloroform-d; Reference=TMS; Temperature=318 K Spectrometer= Varian CFT-20 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | W5-1660-0-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AA-0-318-2 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JX-2015-6-4441 |
- CXQSCYIVCSCSES-UHFFFAOYSA-N
- Pentane, 3-chloro-
- 3-Chloropentane
- 3-Chloranylpentane
- 1-Ethylpropyl chloride
- EINECS 210-467-4
| Title | Journal or Book | Year |
|---|---|---|
| Nature of substituent effects in nuclear magnetic resonance spectroscopy. 1. Factor analysis of carbon-13 chemical shifts in aliphatic halides | The Journal of Organic Chemistry | 1980 |
This compound is available in the following databases:
Wiley SmartSpectra Vapor Phase IR Database Collection
Author: Wiley
Designed for use with Wiley’s KnowItAll IR Spectral Library collection, this computed VPIR database can be used in unknown identification to expand your available chemical compound coverage and improve your analytical workflow. Learn more.
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.