Benzenepropanal
- Formula: C9H10O
- Molecular weight: 134.1751
- IUPAC Standard InChI: InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2
- IUPAC Standard InChIKey: YGCZTXZTJXYWCO-UHFFFAOYSA-N
- CAS Registry Number: 104-53-0
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Species with the same structure:
- Other names: Hydrocinnamaldehyde; β-Phenylpropionaldehyde; Benzylacetaldehyde; Dihydrocinnamaldehyde; Hydrocinnamic aldehyde; 3-Phenyl-1-propanal; 3-Phenylpropanal; 3-Phenylpropionaldehyde; 3-Phenylpropylaldehyde; Propionaidehyde, 3-phenyl-; 3-Phenylpropan-1-al; NSC 9271; phenyl propionaldehyde
- Information on this page:
- Other data available:
- Options:
Normal alkane RI, non-polar column, temperature ramp
Go To: Top, 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
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-1 | HP-1 | DB-5MS | ZB-5 | ZB-5 |
| Column length (m) | 50. | 50. | 30. | 60. | 60. |
| Carrier gas | Helium | Helium | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.20 | 0.20 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.33 | 0.33 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 60. | 50. | 40. | 40. |
| Tend (C) | 250. | 250. | 250. | 250. | 250. |
| Heat rate (K/min) | 2. | 2. | 2. | 6. | 6. |
| Initial hold (min) | 5. | 7. | 7. | ||
| Final hold (min) | 20. | 20. | 1. | 1. | |
| I | 1123. | 1133. | 1163. | 1178. | 1178. |
| Reference | Breme, Langle, et al., 2008 | Breme, Langle, et al., 2008 | Cheng, Liu, et al., 2008 | Dötterl and Jürgens, 2005 | Dötterl, Wolfe, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | HP-1 | DB-5 | SPB-1 |
| Column length (m) | 50. | 30. | 50. |
| Carrier gas | He | He | |
| Substrate | |||
| Column diameter (mm) | 0.2 | 0.25 | 0.2 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.33 |
| Tstart (C) | 60. | 60. | 40. |
| Tend (C) | 250. | 240. | 200. |
| Heat rate (K/min) | 2. | 3. | 3. |
| Initial hold (min) | 60. | 3. | |
| Final hold (min) | 30. | ||
| I | 1122. | 1160. | 1132. |
| Reference | Fernandez, Lizzani-Cuvelier, et al., 2005 | da Silva, Luz, et al., 2003 | Wong and Lai, 1996 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Breme, Langle, et al., 2008
Breme, K.; Langle, S.; Fernandez, X.; Meierhenrich, U.J.; Brevard, H.; Joulain, D.,
Character impact odorants from Brassicaceae by aroma extracts dilution analysis (AEDA): Brassica cretica and Brassica insularis,
Flavour Fragr. J., 2008, 24, 2, 88-93, https://doi.org/10.1002/ffj.1912
. [all data]
Cheng, Liu, et al., 2008
Cheng, S.-S.; Liu, J.-Y.; Lin, C.-Y.; Hsui, Y.-R.; Lu, M.-C.; Wu, W.-J.; Chang, S.-T.,
Terminating red imported fire ants using Cinnamomum osmophloeum leaf essential oil,
Bioresour. Technol., 2008, 99, 4, 889-893, https://doi.org/10.1016/j.biortech.2007.01.039
. [all data]
Dötterl and Jürgens, 2005
Dötterl, S.; Jürgens, A.,
Spatial fragrance patterns in flowers of Silene latifolia: Lilac compounds as olfactory nectar guides?,
Plant Systematics and Evolution, 2005, 255, 1-2, 99-109, https://doi.org/10.1007/s00606-005-0344-2
. [all data]
Dötterl, Wolfe, et al., 2005
Dötterl, S.; Wolfe, L.M.; Jürgens, A.,
Qualitative and quantitative analyses of flower scent in Silene latifolia,
Phytochemistry, 2005, 66, 2, 203-213, https://doi.org/10.1016/j.phytochem.2004.12.002
. [all data]
Fernandez, Lizzani-Cuvelier, et al., 2005
Fernandez, X.; Lizzani-Cuvelier, L.; Loiseau, A.-M.; Perichet, C.; Delbecque, C.; Arnaudo, J.-F.,
Chemical composition of the essential oils from Turkish and Honduras Styrax,
Flavour Fragr. J., 2005, 20, 1, 70-73, https://doi.org/10.1002/ffj.1370
. [all data]
da Silva, Luz, et al., 2003
da Silva, J.D.; Luz, A.I.R.; da Silva, M.H.L.; Andrade, E.H.A.; Soghbi, M.G.B.; Maia, J.G.S.,
Essential oils of the leaves and stems of four Psidium spp.,
Flavour Fragr. J., 2003, 18, 3, 240-243, https://doi.org/10.1002/ffj.1219
. [all data]
Wong and Lai, 1996
Wong, K.C.; Lai, F.Y.,
Volatile constituents from the fruits of four Syzygium species grown in Malaysia,
Flavour Fragr. J., 1996, 11, 1, 61-66, https://doi.org/10.1002/(SICI)1099-1026(199601)11:1<61::AID-FFJ539>3.0.CO;2-1
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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