vitispirane

1-oxaspiro[4.5]dec-7-ene, 2,10,10-trimethyl-6-methylene-

CAS: 65416-59-3 C13 H20 O MW: 192.30160000 floral

Identification

Namevitispirane
CAS Number65416-59-3
FDA UNIIV63S23G8VK
Molecular FormulaC13 H20 O
Molecular Weight192.30160000
Nikkaji NumberJ20.178B

Regulatory

Physical Properties

Appearance colorless to pale yellow solid (est)
Assay 95.00 to 100.00 sum of isomers
Food Chemicals Codex Listed No
Melting Point 49.00 °C. @ 760.00 mm Hg
Boiling Point 258.00 to 259.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.022000 mmHg @ 25.00 °C. (est)
Flash Point 224.00 °F. TCC ( 106.67 °C. )
logP (o/w) 3.619 (est)
Soluble in alcohol
Insoluble in water

Organoleptic Properties

Odor Description at 1.00 % in propylene glycol.

Safety Information

Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavoring agents
Recommendation for vitispirane usage levels up tonot for fragrance use.
Maximised Survey-derived Daily Intakes (MSDI-EU)0.65 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI)3200 (μg/person/day)
Threshold of Concern90 (μg/person/day)
Structure ClassIII
Dairy products, excluding products of category 02.0 (01.0)3.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0)2.00000
Edible ices, including sherbet and sorbet (03.0)3.00000
Processed fruit (04.1)2.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2)-
Confectionery (05.0)10.00000
Chewing gum (05.3)-
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0)5.00000
Bakery wares (07.0)10.00000
Meat and meat products, including poultry and game (08.0)2.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0)2.00000
Eggs and egg products (10.0)-
Sweeteners, including honey (11.0)-
Salts, spices, soups, sauces, salads, protein products, etc. (12.0)5.00000
Foodstuffs intended for particular nutritional uses (13.0)10.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1)3.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2)10.00000
Ready-to-eat savouries (15.0)15.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0)5.00000

No supplier data available

Potential Uses

None Found

Natural Occurrence

grape plant grapefruit juice - 0.0006 mg/kg vanilla wine port wine - up to 2 mg/kg wine red wine - up to 0.11 mg/kg wine white wine - up to 0.32 mg/kg witch hazel leaf oil @ 0.09% Data

Synonyms

6- methylene-2,10,10-trimethyl-1-oxaspiro(4.5)dec-7-ene 6- methylene-2,10,10-trimethyl-1-oxaspiro[4.5]dec-7-ene 1- oxaspiro[4.5]dec-7-ene, 2,10,10-trimethyl-6-methylene- 2,6,6- trimethyl-10-methylidene-1-oxaspiro[4.5]dec-8-ene 2,10,10- trimethyl-6-methylene-1-oxaspiro(4.5)dec-7-ene 2,10,10- trimethyl-6-methylidene-1-oxaspiro[4.5]dec-7-ene PubMed: Enantioselective high performance liquid chromatography and supercritical fluid chromatography separation of spirocyclic terpenoid flavor compounds. PubMed: Pinot Noir wine composition from different vine vigour zones classified by remote imaging technology. PubMed: Timing of cluster light environment manipulation during grape development affects C13 norisoprenoid and carotenoid concentrations in Riesling. PubMed: Effect of freeze-drying and oven-drying on volatiles and phenolics composition of grape skin. PubMed: Rapid tool for assessment of C13 norisoprenoids in wines. PubMed: Carotenoid breakdown products the-norisoprenoids-in wine aroma. PubMed: Syntheses of Theaspirone and Vitispirane via Palladium(II)-Catalyzed Oxaspirocyclization. PubMed: Composition of essential oil of Ledum palustre.