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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16BrNO2
Molecular Weight 274.154
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Meta-DOB, (S)-

SMILES

COC1=CC(OC)=C(C[C@H](C)N)C=C1Br

InChI

InChIKey=YFSLPSITQIUFQK-ZETCQYMHSA-N
InChI=1S/C11H16BrNO2/c1-7(13)4-8-5-9(12)11(15-3)6-10(8)14-2/h5-7H,4,13H2,1-3H3/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H16BrNO2
Molecular Weight 274.154
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:23:24 GMT 2023
Edited
by admin
on Sat Dec 16 19:23:24 GMT 2023
Record UNII
44A8BLU73Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Meta-DOB, (S)-
Common Name English
(αS)-5-Bromo-2,4-dimethoxy-α-methylbenzeneethanamine
Systematic Name English
Benzeneethanamine, 5-bromo-2,4-dimethoxy-α-methyl-, (αS)-
Systematic Name English
5-bromo-2,4-dimethoxyamphetamine, (S)-
Systematic Name English
Code System Code Type Description
CAS
1336757-34-6
Created by admin on Sat Dec 16 19:23:24 GMT 2023 , Edited by admin on Sat Dec 16 19:23:24 GMT 2023
PRIMARY
FDA UNII
44A8BLU73Q
Created by admin on Sat Dec 16 19:23:24 GMT 2023 , Edited by admin on Sat Dec 16 19:23:24 GMT 2023
PRIMARY
PUBCHEM
166177278
Created by admin on Sat Dec 16 19:23:24 GMT 2023 , Edited by admin on Sat Dec 16 19:23:24 GMT 2023
PRIMARY
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