1,2-Butadiene
Compound with spectra: 4 NMR, 1 FTIR, and 7 MS (GC)
| SpectraBase Compound ID | CgZQQ1ChMy0 |
|---|---|
| InChI | InChI=1S/C4H6/c1-3-4-2/h4H,1H2,2H3 |
| InChIKey | QNRMTGGDHLBXQZ-UHFFFAOYSA-N |
| Mol Weight | 54.09 g/mol |
| Molecular Formula | C4H6 |
| Exact Mass | 54.04695 g/mol |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AA-0-20-5 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | HE-1982-0-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JZ-1992-17-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AD-0-4551-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AA-0-21-1 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | J-50-165-0 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Solvent | not reported |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | NEAT |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | Unknown |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
- Allene, methyl-
- Methylallene
- Buta-1,2-diene
- 1-Methylallene
- CH2=C=CHCH3
- HSDB 5705
- EINECS 209-674-2
| Title | Journal or Book | Year |
|---|---|---|
| An additivity relation for carbon-13 chemical shifts in substituted allenes | Recueil des Travaux Chimiques des Pays-Bas | 2010 |
| Carbon-13 spectra of allenes | Journal of the American Chemical Society | 1972 |
This compound is available in the following databases:
KnowItAll GC-MS Library
Author: Wiley
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KnowItAll NMR Spectral Library
Author: Wiley
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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.