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(Q29414987)
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English
isobutyl methyl ether
chemical compound
1-methoxy-2-methylpropane
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ether
0 references
mass
88.088815004
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅H₁₂O
0 references
canonical SMILES
CC(C)COC
0 references
found in taxon
liquorice
1 reference
stated in
Components of essential oil from the root of Glycyrrhiza glabra.
Identifiers
InChI
InChI=1S/C5H12O/c1-5(2)4-6-3/h5H,4H2,1-3H3
1 reference
reference URL
https://pubchem.ncbi.nlm.nih.gov/compound/12250
retrieved
April 2018
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
0 references
CAS Registry Number
625-44-5
1 reference
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=625-44-5
ChemSpider ID
11749
0 references
PubChem CID
12250
1 reference
matched by identifier from
InChIKey
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
UniChem compound ID
25085040
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP003903
0 references
NMRShiftDB structure ID
20026629
1 reference
matched by identifier from
InChIKey
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
DSSTox substance ID
DTXSID70211540
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00134031
0 references
Human Metabolome Database ID
HMDB0252015
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
Google Knowledge Graph ID
/g/11c75p5ftx
0 references
Sitelinks
Wikipedia
(3 entries)
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dewiki
Isobutylmethylether
eowiki
Metila izobutila etero
zhwiki
甲基异丁基醚
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