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English
2-Heptanol, 4-methyl-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
130.135765196
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₈O
0 references
canonical SMILES
OC(C)CC(C)CCC
0 references
found in taxon
Osmanthus fragrans
1 reference
stated in
Headspace Analysis of Osmanthus fragrans Lour.
Identifiers
InChI
InChI=1S/C8H18O/c1-4-5-7(2)6-8(3)9/h7-9H,4-6H2,1-3H3
0 references
InChIKey
GUHWHNUGIGOSCN-UHFFFAOYSA-N
0 references
CAS Registry Number
56298-90-9
1 reference
InChIKey
GUHWHNUGIGOSCN-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=56298-90-9
PubChem CID
143345
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
ChEBI ID
165509
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
SureChEMBL ID
SCHEMBL1658535
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
25469462
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60875771
0 references
DSSTOX compound identifier
DTXCID001013890
0 references
Human Metabolome Database ID
HMDB0031589
1 reference
based on heuristic
inferred from InChIKey
LIPID MAPS ID
LMFA05000630
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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