Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C9H13N.H2O4S |
Molecular Weight | 374.528 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.[2H]C([2H])([2H])[C@H](N)CC1=CC=CC=C1.[2H]C([2H])([2H])[C@H](N)CC2=CC=CC=C2
InChI
InChIKey=PYHRZPFZZDCOPH-BDDWYDIWSA-N
InChI=1S/2C9H13N.H2O4S/c2*1-8(10)7-9-5-3-2-4-6-9;1-5(2,3)4/h2*2-6,8H,7,10H2,1H3;(H2,1,2,3,4)/t2*8-;/m00./s1/i2*1D3;
Molecular Formula | H2O4S |
Molecular Weight | 98.078 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C9H13N |
Molecular Weight | 138.2247 |
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
Edited
Sat Dec 16 09:08:58 GMT 2023
by
admin
on
Sat Dec 16 09:08:58 GMT 2023
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Record UNII |
Y5VD39XKW0
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Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID3047845
Created by
admin on Sat Dec 16 09:08:58 GMT 2023 , Edited by admin on Sat Dec 16 09:08:58 GMT 2023
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Y5VD39XKW0
Created by
admin on Sat Dec 16 09:08:58 GMT 2023 , Edited by admin on Sat Dec 16 09:08:58 GMT 2023
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60196298
Created by
admin on Sat Dec 16 09:08:58 GMT 2023 , Edited by admin on Sat Dec 16 09:08:58 GMT 2023
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119039-59-7
Created by
admin on Sat Dec 16 09:08:58 GMT 2023 , Edited by admin on Sat Dec 16 09:08:58 GMT 2023
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