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(Q63409602)
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English
No label defined
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
132.115029752
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₁₆O₂
0 references
canonical SMILES
CCC(OCC)OCC
0 references
found in taxon
Eucalyptus leucoxylon
1 reference
stated in
Composition of Australian Honey Extractives. 1. Norisoprenoids, Monoterpenes, and Other Natural Volatiles from Blue Gum (Eucalyptus leucoxylon) and Yellow Box (Eucalyptus melliodora) Honeys
Eucalyptus melliodora
1 reference
stated in
Composition of Australian Honey Extractives. 1. Norisoprenoids, Monoterpenes, and Other Natural Volatiles from Blue Gum (Eucalyptus leucoxylon) and Yellow Box (Eucalyptus melliodora) Honeys
Identifiers
InChI
InChI=1S/C7H16O2/c1-4-7(8-5-2)9-6-3/h7H,4-6H2,1-3H3
0 references
InChIKey
MBNMGGKBGCIEGF-UHFFFAOYSA-N
0 references
CAS Registry Number
4744-08-5
1 reference
InChIKey
MBNMGGKBGCIEGF-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=4744-08-5
PubChem CID
20858
1 reference
matched by identifier from
InChIKey
InChIKey
MBNMGGKBGCIEGF-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL25094
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MBNMGGKBGCIEGF-UHFFFAOYSA-N
UniChem compound ID
8008602
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP005938
0 references
MSBNK-Fac_Eng_Univ_Tokyo-JP005853
0 references
MSBNK-Fac_Eng_Univ_Tokyo-JP008636
0 references
DSSTox substance ID
DTXSID8063593
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
MBNMGGKBGCIEGF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID8040567
0 references
NSC number
227930
0 references
FL number
06.069
1 reference
quotation
CAS no.: 4744-08-5
(English)
stated in
EFSA database
retrieved
23 January 2021
FL number
06.069
AICS Chemical ID (BEING DELETED)
8839
0 references
UNII
944H8XF5QD
1 reference
matched by identifier from
InChIKey
InChIKey
MBNMGGKBGCIEGF-UHFFFAOYSA-N
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