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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H22O
Molecular Weight 182.3025
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CASSYRANE, (2R,5S)-

SMILES

CCC[C@]1(O[C@@H](C)C=C1)C(C)(C)C

InChI

InChIKey=BWJMAXUUBRFWGV-CMPLNLGQSA-N
InChI=1S/C12H22O/c1-6-8-12(11(3,4)5)9-7-10(2)13-12/h7,9-10H,6,8H2,1-5H3/t10-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H22O
Molecular Weight 182.3025
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:46:01 GMT 2023
Edited
by admin
on Sat Dec 16 14:46:01 GMT 2023
Record UNII
V04F09MN1X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CASSYRANE, (2R,5S)-
Common Name English
FURAN, 2-(1,1-DIMETHYLETHYL)-2,5-DIHYDRO-5-METHYL-2-PROPYL-, (2R,5S)-
Systematic Name English
FEMA NO. 4731, (2R,5S)-
Code English
Code System Code Type Description
CAS
1313049-85-2
Created by admin on Sat Dec 16 14:46:01 GMT 2023 , Edited by admin on Sat Dec 16 14:46:01 GMT 2023
PRIMARY
PUBCHEM
124561928
Created by admin on Sat Dec 16 14:46:01 GMT 2023 , Edited by admin on Sat Dec 16 14:46:01 GMT 2023
PRIMARY
FDA UNII
V04F09MN1X
Created by admin on Sat Dec 16 14:46:01 GMT 2023 , Edited by admin on Sat Dec 16 14:46:01 GMT 2023
PRIMARY