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(Q104253343)
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English
(1R,2R,5S)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(2R)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
1 reference
based on heuristic
inferred from SMILES
mass
152.120115132
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Bicyclo[3.1.1]Heptan-3-One, 2,6,6-Trimethyl-, [1S-(1a,2ss,5a)]-
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
isopinocamphone
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(E)-3-pinanone
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
trans-Pinocamphone (pinocamphone)
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₆O
0 references
canonical SMILES
O=C1CC2CC(C1C)C2(C)C
0 references
isomeric SMILES
C[C@H]1C(=O)C[C@@H]2C[C@H]1C2(C)C
0 references
found in taxon
Aloysia gratissima
1 reference
stated in
Composition of Aloysia gratissima leaf essential oil
Juniperus durangensis
1 reference
stated in
The Volatile Leaf Oils of Two Rare Junipers from Western Mexico:Juniperus durangensis and Juniperus jaliscana
Juniperus jaliscana
1 reference
stated in
The Volatile Leaf Oils of Two Rare Junipers from Western Mexico:Juniperus durangensis and Juniperus jaliscana
Hyssopus officinalis
2 references
stated in
Spasmolytic action of the essential oil from Hyssopus officinalis L. var. decumbens and its major components
stated in
Essential oils and glycosidic bound volatiles from leaves, stems, flowers and roots ofHyssopus officinalis L. (lamiaceae)
Aframomum melegueta
1 reference
stated in
Aromatic Plants of Tropical Central Africa. XI. Essential Oils of Leaf and Seed ofAframomum melegueta(Roscoe) K. Schum. from Central African Republic
Artemisia alba
1 reference
stated in
Essential Oil Production by BelgianArtemisia alba(Turra) before and after Micropropagation
Hyssopus seravschanicus
1 reference
stated in
Investigation of the essential oil of Hyssopus zeravshanicus
Pityophthorus pityographus
1 reference
stated in
Identification of ?pityol? and ?grandisol? as pheromone components of the bark beetle, Pityophthorus pityographus
Sideritis lyciae
1 reference
stated in
Essential Oil ofSideritis lyciaBoiss. et Heldr
Conopeum seurati
1 reference
stated in
Terpenoids from a Black Sea Bryozoan Conopeum seuratum
Clinopodium grandiflorum
1 reference
stated in
Composition of the Essential Oil of Calamintha grandiflora
Clinopodium carolinianum
1 reference
stated in
Composition of the Essential Oil of Calamintha grandiflora
Identifiers
InChI
InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3/t6-,7+,8-/m1/s1
0 references
InChIKey
MQPHVIPKLRXGDJ-GJMOJQLCSA-N
0 references
CAS Registry Number
473-62-1
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
10329459
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MQPHVIPKLRXGDJ-GJMOJQLCSA-N
UniChem compound ID
5483547
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID201315632
1 reference
matched by identifier from
InChIKey
InChIKey
MQPHVIPKLRXGDJ-GJMOJQLCSA-N
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