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Details

Stereochemistry RACEMIC
Molecular Formula C15H24
Molecular Weight 204.3511
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isocomene, (±)-

SMILES

C[C@@H]1CC[C@@]2(C)C(C)=C[C@]3(C)CCC[C@]123

InChI

InChIKey=SAOJPWFHRMUCFN-UQOMUDLDSA-N
InChI=1S/C15H24/c1-11-6-9-14(4)12(2)10-13(3)7-5-8-15(11,13)14/h10-11H,5-9H2,1-4H3/t11-,13+,14+,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H24
Molecular Weight 204.3511
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:25:21 GMT 2023
Edited
by admin
on Sat Dec 16 18:25:21 GMT 2023
Record UNII
UF2Y987D5F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Isocomene, (±)-
Common Name English
CYCLOPENTA(C)PENTALENE, 1,2,3,3A,5A,6,7,8-OCTAHYDRO-1,3A,4,5A-TETRAMETHYL-, (1.ALPHA.,3A.ALPHA.,5A.BETA.,8AR*)-
Systematic Name English
CYCLOPENTA(C)PENTALENE, 1,2,3,3A,5A,6,7,8-OCTAHYDRO-1,3A,4,5A-TETRAMETHYL-, (1.ALPHA.,3A.ALPHA.,5A.BETA.,8AR*)-(±)-
Systematic Name English
REL-(1R,3AS,5AS,8AR)-1,2,3,3A,5A,6,7,8-OCTAHYDRO-1,3A,4,5A-TETRAMETHYLCYCLOPENTA(C)PENTALENE
Systematic Name English
(±)-Isocomene
Common Name English
ISOCOMENE
Common Name English
Code System Code Type Description
PUBCHEM
57501472
Created by admin on Sat Dec 16 18:25:21 GMT 2023 , Edited by admin on Sat Dec 16 18:25:21 GMT 2023
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EPA CompTox
DTXSID50992204
Created by admin on Sat Dec 16 18:25:21 GMT 2023 , Edited by admin on Sat Dec 16 18:25:21 GMT 2023
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CAS
71629-00-0
Created by admin on Sat Dec 16 18:25:21 GMT 2023 , Edited by admin on Sat Dec 16 18:25:21 GMT 2023
PRIMARY
FDA UNII
UF2Y987D5F
Created by admin on Sat Dec 16 18:25:21 GMT 2023 , Edited by admin on Sat Dec 16 18:25:21 GMT 2023
PRIMARY
WIKIPEDIA
Isocomene
Created by admin on Sat Dec 16 18:25:21 GMT 2023 , Edited by admin on Sat Dec 16 18:25:21 GMT 2023
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