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Structure

Butyrophenone-2',3',4',5',6'-d5

CAS
39058-44-1
Catalog Number
ACM39058441
Category
Other Products
Molecular Weight
153.23
Molecular Formula
C10H7D5O

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Specification

Synonyms
1-(Phenyl-D5)Butan-1-One
IUPAC Name
1-(2,3,4,5,6-pentadeuteriophenyl)butan-1-one
Canonical SMILES
CCCC(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3/i3D,4D,5D,7D,8D
InChI Key
FFSAXUULYPJSKH-LOOCXSPQSA-N
Chemical Formula
C6D5COCH2CH2CH3
Exact Mass
153.12000
Isomeric SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)CCC)[2H])[2H]
Stability
Stable if stored under recommended conditions. After three years, the compound should be re-analyzed for chemical purity before use.
Storage Conditions
Store at room temperature
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