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Details

Stereochemistry ACHIRAL
Molecular Formula 2C10H15NO2.H2O4S
Molecular Weight 460.542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2C-H SULFATE

SMILES

OS(O)(=O)=O.COC1=CC=C(OC)C(CCN)=C1.COC2=CC=C(OC)C(CCN)=C2

InChI

InChIKey=QCFDUUIGVRRRNK-UHFFFAOYSA-N
InChI=1S/2C10H15NO2.H2O4S/c2*1-12-9-3-4-10(13-2)8(7-9)5-6-11;1-5(2,3)4/h2*3-4,7H,5-6,11H2,1-2H3;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula C10H15NO2
Molecular Weight 181.2316
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O4S
Molecular Weight 98.078
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

PubMed

Patents

Substance Class Chemical
Record UNII
K54B9TC3PA
Record Status Validated (UNII)
Record Version