Results for:
PubChem ID: 6429333

(E)-2-phenylbut-2-enal

Compound Details

Synonymous names	2-PHENYL-2-BUTENAL (E)-2-phenylbut-2-enal 2-Phenylbutenal 2-Phenylcrotonaldehyde 4411-89-6 alpha-Phenylcrotonaldehyde (E)-2-Phenylcrotonaldehyde 2-Phenyl-2-butenal, (2E)- 2-Butenal, 2-phenyl alpha-Ethylidenebenzeneacetaldehyde FEMA No. 3224, E- N8EMO6YRV9 55088-52-3 54075-09-1 2-phenylbut-2-enal 2-Phenyl-2-buten-1-al UNII-N8EMO6YRV9 Crotonaldehyde, 2-phenyl- UNII-E8991Q8HSC FEMA No. 3224 Phenylcrotonaldehyd 2-Phenyl-2-butenal, (E)+(Z) EINECS 224-567-0 2-Phenyl-Crotonaldehyde Benzeneacetaldehyde, alpha-ethylidene-, (E)- (2e)-2-phenyl-2-butenal (2E)-2-phenylbut-2-enal Benzeneacetaldehyde, alpha-ethylidene-, (alphaE)- SCHEMBL950633 a-Ethylidene-Benzeneacetaldehyde E8991Q8HSC CHEBI:89904 FEMA 3224 2-Phenyl-2-butenal,(E)+(Z) alpha -ethylidenbenzeneacetaldehyde DYAOGZLLMZQVHY-MBXJOHMKSA-N alpha-Ethylidene-Benzeneacetaldehyde alpha -ethylidene-phenylacetaldehyde a-Ethylidenebenzeneacetaldehyde, 9CI EINECS 259-476-5 MFCD00053158 alpha -ethylidene benzene acetaldehyde AKOS025396900 2-Phenylacetaldehyde, alpha -ethylidene NS00049278 Q27162088 BENZENEACETALDEHYDE, .ALPHA.-ETHYLIDENE-, (E)- BENZENEACETALDEHYDE, .ALPHA.-ETHYLIDENE-, (.ALPHA.E)-
Microorganism:	Yes
IUPAC name	(E)-2-phenylbut-2-enal
SMILES	CC=C(C=O)C1=CC=CC=C1
Inchi	InChI=1S/C10H10O/c1-2-9(8-11)10-6-4-3-5-7-10/h2-8H,1H3/b9-2-
Formula	C10H10O
PubChem ID	6429333
Molweight	146.19
LogP	2.2
Atoms	11
Bonds	2
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	aromatic compounds aromatic aldehydes aldehydes benzenoids
CHEBI-ID	89904
Supernatural-ID	SN0078543-01

mVOC Specific Details

Boiling Point	Degree Reference 84 median
MS-Links	MS-MS Spectrum 153495 MS-MS Spectrum 153497 MS-MS Spectrum 153496 MS-MS Spectrum 90358 MS-MS Spectrum 90359 MS-MS Spectrum 90357

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Candida Albicans ATCC MYA-2876, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Glabrata ATCC 90030, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Tropicalis ATCC 750, American Type Culture Collection Costa et al. 2020 Eukaryota Tuber Borchii na na Splivallo and Ebeler 2015 Eukaryota Tuber Aestivum n/a Agricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain). Diaz et al. 2003 Eukaryota Tuber Melanosporum n/a Agricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain). Diaz et al. 2003 Eukaryota Tuber Melanosporum None T. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b Eukaryota Tuber Indicum None T. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b Eukaryota Tuber Aestivum None Agricultural Centre of Castilla and León Community Diaz et al. 2003 Eukaryota Tuber Melanosporum None Agricultural Centre of Castilla and León Community Diaz et al. 2003

Method

Kingdom Species Growth Medium Applied Method Verification Eukaryota Candida Albicans YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Glabrata YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Tropicalis YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Tuber Borchii na SPME-GC/MS/O); GC-R yes Eukaryota Tuber Aestivum n/a n/a no Eukaryota Tuber Melanosporum n/a n/a no Eukaryota Tuber Melanosporum None None yes Eukaryota Tuber Indicum None None yes Eukaryota Tuber Aestivum None None no Eukaryota Tuber Melanosporum None None no