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(Q104253281)
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Bicyclo[3.1.1]Heptan-3-One, 2,6,6-Trimethyl-, [1S-(1a,2ss,5a)]-
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
trans-Pinocamphone (pinocamphone)
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
isopinocamphone
1 reference
based on heuristic
inferred from InChI
(1R,2R,5S)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
1 reference
based on heuristic
inferred from InChI
(E)-3-pinanone
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₆O
0 references
canonical SMILES
O=C1CC2CC(C1C)C2(C)C
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isomeric SMILES
C[C@@H]1C(=O)C[C@H]2C[C@H]1C2(C)C
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found in taxon
Dracocephalum nutans
1 reference
stated in
An Oxygenated Tetrahydrobergamotene from the Essential Oil of Dracocephalum nutans*
Aloysia gratissima
1 reference
stated in
Composition of Aloysia gratissima leaf essential oil
Chamaemelum nobile
1 reference
stated in
Anthemis
Melissa officinalis
1 reference
stated in
Constituents of the Essential Oil from Melissa officinalis
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)
Kunzea salina
1 reference
stated in
The Leaf Essential Oil ofAngasomyrtus salinaTrudgen & Keighery
Artemisia alba
1 reference
stated in
Essential Oil Production by BelgianArtemisia alba(Turra) before and after Micropropagation
Mentha
1 reference
stated in
Analysis of the Essential Oil of the So-called“Mentha mirennae”Bruno by GC and GC/MS
Pityophthorus pityographus
1 reference
stated in
Identification of ?pityol? and ?grandisol? as pheromone components of the bark beetle, Pityophthorus pityographus
Xylopia aromatica
1 reference
stated in
Chemical and Biological Studies ofXylopia longifoliaA. DC. Essential Oils
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+/m0/s1
0 references
InChIKey
MQPHVIPKLRXGDJ-XLPZGREQSA-N
0 references
PubChem CID
12311188
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MQPHVIPKLRXGDJ-XLPZGREQSA-N
UniChem compound ID
64866100
1 reference
stated in
UniChem
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