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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16N2O.ClH
Molecular Weight 240.729
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-METHOXY-N-METHYLTRYPTAMINE HYDROCHLORIDE

SMILES

Cl.CNCCC1=CNC2=CC=C(OC)C=C12

InChI

InChIKey=QVQIZTATJNGCKW-UHFFFAOYSA-N
InChI=1S/C12H16N2O.ClH/c1-13-6-5-9-8-14-12-4-3-10(15-2)7-11(9)12;/h3-4,7-8,13-14H,5-6H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C12H16N2O
Molecular Weight 204.2682
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
3390M5391J
Record Status Validated (UNII)
Record Version