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;
Approval Year
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Code System | Code | Type | Description | ||
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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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PRIMARY | |||
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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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PRIMARY | |||
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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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PRIMARY | |||
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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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PRIMARY |
SUBSTANCE RECORD