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Details

Stereochemistry ACHIRAL
Molecular Formula C13H18O
Molecular Weight 190.2814
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of MEGASTIGMATRIENONE A

SMILES

C\C=C\C=C1/C(C)=CC(=O)CC1(C)C

InChI

InChIKey=CBQXHTWJSZXYSK-DVIJZSFDSA-N
InChI=1S/C13H18O/c1-5-6-7-12-10(2)8-11(14)9-13(12,3)4/h5-8H,9H2,1-4H3/b6-5+,12-7+

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
MEGASTIGMATRIENONE A
Common Name English
2-CYCLOHEXEN-1-ONE, 4-(2E)-2-BUTEN-1-YLIDENE-3,5,5-TRIMETHYL-, (4Z)-
Systematic Name English
MEGASTIGMATRIENONE 1
Common Name English
2-CYCLOHEXEN-1-ONE, 4-(2-BUTENYLIDENE)-3,5,5-TRIMETHYL-, (Z,E)-
Common Name English
2-CYCLOHEXEN-1-ONE, 4-(2E)-2-BUTENYLIDENE-3,5,5-TRIMETHYL-, (4Z)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
226-825-8
Created by admin on Sat Dec 16 01:23:13 GMT 2023 , Edited by admin on Sat Dec 16 01:23:13 GMT 2023
PRIMARY
PUBCHEM
6437599
Created by admin on Sat Dec 16 01:23:13 GMT 2023 , Edited by admin on Sat Dec 16 01:23:13 GMT 2023
PRIMARY
CAS
5492-79-5
Created by admin on Sat Dec 16 01:23:13 GMT 2023 , Edited by admin on Sat Dec 16 01:23:13 GMT 2023
PRIMARY
FDA UNII
3QY2F7PCN3
Created by admin on Sat Dec 16 01:23:13 GMT 2023 , Edited by admin on Sat Dec 16 01:23:13 GMT 2023
PRIMARY
SUBSTANCE RECORD
Structure of MEGASTIGMATRIENONE A
NIH
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