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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H21NO2.ClH
Molecular Weight 259.772
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DOET hydrochloride, (R)-

SMILES

Cl.CCC1=CC(OC)=C(C[C@@H](C)N)C=C1OC

InChI

InChIKey=NFWFNZNUXAZEQG-SBSPUUFOSA-N
InChI=1S/C13H21NO2.ClH/c1-5-10-7-13(16-4)11(6-9(2)14)8-12(10)15-3;/h7-9H,5-6,14H2,1-4H3;1H/t9-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C13H21NO2
Molecular Weight 223.3113
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:18:56 GMT 2023
Edited
by admin
on Sat Dec 16 19:18:56 GMT 2023
Record UNII
AR5A9F9MA9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DOET hydrochloride, (R)-
Common Name English
DOE hydrochloride, (R)-
Common Name English
Benzeneethanamine, 4-ethyl-2,5-dimethoxy-α-methyl-, hydrochloride, (R)-
Systematic Name English
Hecate hydrochloride, (R)-
Common Name English
2,5-Dimethoxy-4-ethylamphetamine hydrochloride, (R)-
Common Name English
(R)(-)-2,5-Dimethoxy-4-ethylamphetamine hydrochloride
Common Name English
Code System Code Type Description
FDA UNII
AR5A9F9MA9
Created by admin on Sat Dec 16 19:18:56 GMT 2023 , Edited by admin on Sat Dec 16 19:18:56 GMT 2023
PRIMARY
CAS
42011-76-7
Created by admin on Sat Dec 16 19:18:56 GMT 2023 , Edited by admin on Sat Dec 16 19:18:56 GMT 2023
PRIMARY
PUBCHEM
60196320
Created by admin on Sat Dec 16 19:18:56 GMT 2023 , Edited by admin on Sat Dec 16 19:18:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID1048889
Created by admin on Sat Dec 16 19:18:56 GMT 2023 , Edited by admin on Sat Dec 16 19:18:56 GMT 2023
PRIMARY
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