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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H18O3
Molecular Weight 198.2588
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-((1R,3R,4R)-4-HYDROXY-3-METHOXYCYCLOHEXYL)-2-METHYLACRYLALDEHYDE, (E)-

SMILES

CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)C=O

InChI

InChIKey=ZTXGCGOIEHBZMQ-OJHBQYHASA-N
InChI=1S/C11H18O3/c1-8(7-12)5-9-3-4-10(13)11(6-9)14-2/h5,7,9-11,13H,3-4,6H2,1-2H3/b8-5+/t9-,10+,11+/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H18O3
Molecular Weight 198.2588
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:33:20 GMT 2023
Edited
by admin
on Sat Dec 16 08:33:20 GMT 2023
Record UNII
D3TG17VNO3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-((1R,3R,4R)-4-HYDROXY-3-METHOXYCYCLOHEXYL)-2-METHYLACRYLALDEHYDE, (E)-
Systematic Name English
Code System Code Type Description
FDA UNII
D3TG17VNO3
Created by admin on Sat Dec 16 08:33:20 GMT 2023 , Edited by admin on Sat Dec 16 08:33:20 GMT 2023
PRIMARY
PUBCHEM
13819084
Created by admin on Sat Dec 16 08:33:20 GMT 2023 , Edited by admin on Sat Dec 16 08:33:20 GMT 2023
PRIMARY
RS_ITEM_NUM
1A01940
Created by admin on Sat Dec 16 08:33:20 GMT 2023 , Edited by admin on Sat Dec 16 08:33:20 GMT 2023
PRIMARY
CAS
109466-74-2
Created by admin on Sat Dec 16 08:33:20 GMT 2023 , Edited by admin on Sat Dec 16 08:33:20 GMT 2023
PRIMARY