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(Q82854377)
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English
Cyclohexanone, 2-methyl-5-(1-methylethyl)-
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
menthane monoterpenoids
0 references
mass
154.135765196
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₈O
0 references
canonical SMILES
O=C1CC(CCC1C)C(C)C
0 references
found in taxon
Mentha longifolia
1 reference
stated in
CNS activity ofMentha rotundifolia andMentha longifolia essential oil in mice and rats
Mentha spicata
1 reference
stated in
CNS activity ofMentha rotundifolia andMentha longifolia essential oil in mice and rats
Echinacea angustifolia
1 reference
stated in
Echinacea: anatomy, phytochemical pattern, and germination of the achene
Echinacea pallida
1 reference
stated in
Echinacea: anatomy, phytochemical pattern, and germination of the achene
Echinacea purpurea
1 reference
stated in
Echinacea: anatomy, phytochemical pattern, and germination of the achene
Identifiers
InChI
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h7-9H,4-6H2,1-3H3
0 references
InChIKey
GCRTVIUGJCJVDD-UHFFFAOYSA-N
0 references
CAS Registry Number
59471-80-6
1 reference
InChIKey
GCRTVIUGJCJVDD-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=59471-80-6
PubChem CID
10362
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
GCRTVIUGJCJVDD-UHFFFAOYSA-N
ChEBI ID
167371
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h7-9H,4-6H2,1-3H3
UniChem compound ID
22829164
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP007394
0 references
DSSTox substance ID
DTXSID90862053
1 reference
matched by identifier from
InChIKey
InChIKey
GCRTVIUGJCJVDD-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10220691
0 references
NSC number
96750
0 references
Human Metabolome Database ID
HMDB0035272
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GCRTVIUGJCJVDD-UHFFFAOYSA-N
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