1,5-Heptadiene, (E)-
- Formula: C7H12
- Molecular weight: 96.1702
- IUPAC Standard InChI: InChI=1S/C7H12/c1-3-5-7-6-4-2/h3-4,6H,1,5,7H2,2H3/b6-4+
- IUPAC Standard InChIKey: ZGXMNEKDFYUNDQ-GQCTYLIASA-N
- CAS Registry Number: 7736-22-3
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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- Other names: trans-1,5-Heptadiene; 1,5-Heptadiene; (5E)-1,5-Heptadiene; 1,trans-5-Heptadiene
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Mass spectrum (electron ionization)
Go To: Top, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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| Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
|---|---|
| Origin | D.HENNEBERG, MAX-PLANCK INSTITUTE, MULHEIM, WEST GERMANY |
| NIST MS number | 62115 |
Gas Chromatography
Go To: Top, Mass spectrum (electron ionization), References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | Squalane | 70. | 681.9 | Soják, Ostrovský, et al., 1980 | N2; Column length: 200. m; Column diameter: 0.25 mm |
| Capillary | Squalane | 70. | 678.8 | Soják, Ostrovský, et al., 1980 | N2; Column length: 70. m; Column diameter: 0.25 mm |
| Capillary | Squalane | 30. | 679. | Döring, Estel, et al., 1974 | Column length: 150. m; Column diameter: 0.25 mm |
Normal alkane RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | Squalane | 70. | 682. | Schomburg, 1966 |
References
Go To: Top, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Soják, Ostrovský, et al., 1980
Soják, L.; Ostrovský, I.; Leclercq, P.A.; Rijks, J.A.,
Identification of n-hepta- and n-octadienes by high-resolution gas chromatography using structure-retention correlations and mass spectrometry,
J. Chromatogr., 1980, 191, 187-198, https://doi.org/10.1016/S0021-9673(00)86379-7
. [all data]
Döring, Estel, et al., 1974
Döring, C.-E.; Estel, D.; Geyer, R.; Wendt, W.-H.,
Kapillargaschromatographische Analyse geradkettiger C8-Diene,
Z. Chem., 1974, 14, 7, 292-293, https://doi.org/10.1002/zfch.19740140730
. [all data]
Schomburg, 1966
Schomburg, G.,
Gaschromatographische Retentionsdaten und Struktur Chemischer Verbindungen. II. Methylverzweigungen und Doppelbindungen in Offenkettigen Kohlenwasserstoffen,
J. Chromatogr., 1966, 23, 1-17, https://doi.org/10.1016/S0021-9673(01)98652-2
. [all data]
Notes
Go To: Top, Mass spectrum (electron ionization), Gas Chromatography, References
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