General Information of Natural Product (ID: NP1172)
  Natural Product Name
Phenyl 2-Ethylbutanoate
  Synonyms
phenyl 2-ethylbutanoate; 54897-51-7; 2-ethyl-butyric acid phenyl ester; phenyl ethyl butyrate; SCHEMBL650209; 2-Ethylbutyric acid, phenyl ester; BS-51520
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  Formula C12H16O2
  Weight 192.25
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C12H16O2/c1-3-10(4-2)12(13)14-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
  InChI Key QTQSMZUPHLTSKC-UHFFFAOYSA-N
  Isomeric SMILES CCC(CC)C(=O)OC1=CC=CC=C1
  Canonical SMILES CCC(CC)C(=O)OC1=CC=CC=C1
  External Links PubChem ID 22012775
CAS ID 54897-51-7

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Pelargonium graveolens L'Her.
  Factor Name: Cultivar Comparison; Seasonal Variation [1]
              Species Info Factor Info
               Experiment Detail
One-month-old rooted stem cuttings of three rosescented geranium cultivars, namely Bourbon type, CIM-Pawan and Kelkar were transplanted at 50 × 50 cm plant spacing in the experimental field of Central Institute of Medicinal and Aromatic Plants, Research Center Purara, Uttarakhand, in October 2007. Plants were irrigated immediately after transplanting and further crops were raised following the normal agricultural practices needed to grow the plant. The experimental site is located between the coordinates 28° 60′ and 31° 29′ N, 77° 49′ and 80° 60 m E, and at an altitude of 1250 m in the Kattyur valley. Climatologically, it is categorized as a sub-temperate (1200-1700 m) zone, where monsoon usually breaks in June and continues up to September. Sampling of the rose-scented geranium cultivars was started from March 2008 and taken on the tenth of every month until February 2009. Samples were collected in triplicate in each season. (A, cv. Bourbon type; B, cv. CIM-Pawan; C, cv. Kelkar; I, spring season; II, summer season; III, rainy season;IV, autumn season; V, winter season).
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               Factor Function
The major components in the essential oil of cv. Bourbon type were geraniol (14.1-34.6%), citronellol (15.2-31.3%), linalool (2.9-9.2%), citronellyl formate (4.4-9.2%), isomenthone (4.5-6.6%), 10-epi-gamma-eudesmol (4.7-6.7%) and geranyl formate (3.8-6.2%). The dominant constituents of the cv. CIM-Pawan essential oil were geraniol (11.9-31.9%), citronellol (16.1-30.2%), citronellyl formate (5.2-8.9%), linalool (3.7-6.4%), isomenthone (4.0-6.3%), 10-epi-gamma-eudesmol (4.4-5.2%) and geranyl formate (4.3-5.0%). However, the chemical composition and odor of cv. Kelkar was quite different from the other two cultivars and the major components found in this oil were citronellol (51.0-63.4%) and isomenthone (9.8-17.8%).
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               Factor Part Location NP Content
 
Pelargonium graveolens cv. Bourbon type: (Harvesting time: spring season)
Fresh herb Iran
NP Content: 0.2 %
 
Pelargonium graveolens cv. Bourbon type: (Harvesting time: summer season)
Fresh herb Iran
NP Content: 0.3 %
 
Pelargonium graveolens cv. Bourbon type: (Harvesting time: autumn season)
Fresh herb Iran
NP Content: 0.3 %
 
Pelargonium graveolens cv. Bourbon type: (Harvesting time: winter season)
Fresh herb Iran
NP Content: 0.6 %
 
Pelargonium graveolens cv. Bourbon type: (Harvesting time: rainy season)
Fresh herb Iran
NP Content: 0.8 %
 
Pelargonium graveolens cv. CIM-Pawan: (Harvesting time: spring season)
Fresh herb Iran
NP Content: 0.1 %
 
Pelargonium graveolens cv. CIM-Pawan: (Harvesting time: summer season)
Fresh herb Iran
NP Content: 0.1 %
 
Pelargonium graveolens cv. CIM-Pawan: (Harvesting time: autumn season)
Fresh herb Iran
NP Content: 0.3 %
 
Pelargonium graveolens cv. CIM-Pawan: (Harvesting time: winter season)
Fresh herb Iran
NP Content: 0.6 %
 
Pelargonium graveolens cv. CIM-Pawan: (Harvesting time: rainy season)
Fresh herb Iran
NP Content: 0.4 %
      Species Name: Thymus vulgaris
  Factor Name: Cultivar Comparison; Seasonal Variation [1]
References
1 Essential oil composition of Pelargonium graveolens L'Her ex Ait. cultivars harvested in different seasons