Results for:
PubChem ID: 5370602

(E)-5-methyl-2-phenylhex-2-enal

Mass-Spectra

Compound Details

Synonymous names	5-Methyl-2-phenyl-2-hexenal 21834-92-4 5-Methyl-2-phenylhex-2-enal (E)-5-methyl-2-phenylhex-2-enal Cocal Fema No. 3199, E- (E)-5-Methyl-2-phenyl-hex-2-enal 2-phenyl-5-methyl-2-hexenal UNII-935DI670UJ 188829-73-4 5-Methyl-2-phenyl-hex-2-enal, (2E)- 935DI670UJ (2E)-5-methyl-2-phenylhex-2-enal 2-Phenyl-5-methylhex-2-enal Benzeneacetaldehyde, alpha-(3-methylbutylidene)-, (E)- Benzeneacetaldehyde, alpha-(3-methylbutylidene)-, (alphaE)- alpha-(3-Methylbutylidene)benzeneacetaldehyde Benzeneacetaldehyde, .alpha.-(3-methylbutylidene)- ?Cocal SCHEMBL891343 UNII-57UW55EC13 95%,as a mixture of isomers FEMA No. 3199 FEMA 3199 2-Hexenal, 5-methyl-2-phenyl- CHEBI:177629 57UW55EC13 WAA83492 EINECS 244-602-3 MFCD00036615 (2E)-5-Methyl-2-phenyl-2-hexenal AKOS024348946 (2E)-5-methyl-2-phenyl-hex-2-enal AM84770 5-Methyl-2-phenyl-2-hexenal (natural) DS-11320 5-Methyl-2-phenyl-2-hexenal, >=96%, FG alpha-(3-Methylbutylidene)-Benzeneacetaldehyde a-(3-Methylbutylidene)benzeneacetaldehyde, 9CI D70128 Benzeneacetaldehyde, alpha-(3-methylbutylidene)- Benzeneacetaldehyde, alpha -(3-methylbutylidene)- W-107517 Q27271558 BENZENEACETALDEHYDE, .ALPHA.-(3-METHYLBUTYLIDENE)-, (E)- BENZENEACETALDEHYDE, .ALPHA.-(3-METHYLBUTYLIDENE)-, (.ALPHA.E)-
Microorganism:	No
IUPAC name	(E)-5-methyl-2-phenylhex-2-enal
SMILES	CC(C)CC=C(C=O)C1=CC=CC=C1
Inchi	InChI=1S/C13H16O/c1-11(2)8-9-13(10-14)12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3/b13-9-
Formula	C13H16O
PubChem ID	5370602
Molweight	188.26
LogP	3.4
Atoms	14
Bonds	4
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	benzenoids aromatic compounds aldehydes aromatic aldehydes
CHEBI-ID	177629
Supernatural-ID	SN0460762-01

mVOC Specific Details

MS-Links

MS-MS Spectrum 154271 MS-MS Spectrum 90982 MS-MS Spectrum 154269 MS-MS Spectrum 90981 MS-MS Spectrum 154270 MS-MS Spectrum 90983

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Tuber Melanosporum T. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b
Method	Kingdom Species Growth Medium Applied Method Verification Eukaryota Tuber Melanosporum yes