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(Q105969941)
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English
(+)-chrysanthenone
chemical compound
(1S,5R)-2,7,7-trimethylbicyclo[3.1.1]hept-2-en-6-one
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Statements
instance of
type of chemical entity
0 references
subclass of
chrysanthenone
1 reference
based on heuristic
inferred from SMILES
mass
150.104465068
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(-)-chrysanthenone
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₄O
0 references
canonical SMILES
CC1=CCC2C(=O)C1C2(C)C
0 references
O=C1C2C(=CCC1C2(C)C)C
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isomeric SMILES
CC1=CC[C@H]2C(=O)[C@@H]1C2(C)C
0 references
Identifiers
InChI
InChI=1S/C10H14O/c1-6-4-5-7-9(11)8(6)10(7,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m0/s1
0 references
InChIKey
IECBDTGWSQNQID-JGVFFNPUSA-N
0 references
CAS Registry Number
38301-80-3
1 reference
InChIKey
IECBDTGWSQNQID-JGVFFNPUSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=38301-80-3
PubChem CID
11789373
0 references
UniChem compound ID
33684878
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID801221097
1 reference
matched by identifier from
InChIKey
InChIKey
IECBDTGWSQNQID-JGVFFNPUSA-N
UNII
5706LMQ84R
1 reference
matched by identifier from
InChIKey
InChIKey
IECBDTGWSQNQID-JGVFFNPUSA-N
841NXH6XEV
1 reference
matched by identifier from
InChIKey
InChIKey
IECBDTGWSQNQID-JGVFFNPUSA-N
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