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Substance Name: beta-Damascone, (E)-
RN: 23726-91-2
UNII: I75J0X33Q6
InChIKey: BGTBFNDXYDYBEY-FNORWQNLSA-N
Molecular Formula
- C13-H20-O
Molecular Weight
- 192.3
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Names and Synonyms
Name of Substance
- beta-Damascone, (E)-
Synonyms
- (E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-buten-1-one
- (E)-1-(2,6,6-Trimethylcyclohex-1-enyl)-2-buten-1-one
- (E)-beta-Damascone
- beta-Damascone
- BRN 2046078
- EC 245-842-1
- EINECS 245-842-1
- FEMA 3243
- Rose dihydroketone
- trans-beta-Damascone
- UNII-I75J0X33Q6
Systematic Names
- (E)-1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-buten-1-one
- 2-Buten-1-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (2E)-
- 2-Buten-1-one, 1-(2,6,6-trimethylcyclohex-1-enyl)-, (E)-
Registry Numbers
CAS Registry Number
- 23726-91-2
FDA UNII
- I75J0X33Q6
System Generated Number
- 0023726912
Structure Descriptors
InChI
InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7H,6,8-9H2,1-4H3/b7-5+InChIKey
BGTBFNDXYDYBEY-FNORWQNLSA-NSmiles
C\C=C\C(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD50 | oral | 2920mg/kg (2920mg/kg) | Food and Cosmetics Toxicology. Vol. 13, Pg. 487, 1975. |