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Details

Stereochemistry ACHIRAL
Molecular Formula C9H14N.CF3O3S
Molecular Weight 285.283
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BUTYLPYRIDINIUM TRIFLATE

SMILES

[O-]S(=O)(=O)C(F)(F)F.CCCC[N+]1=CC=CC=C1

InChI

InChIKey=BEFWDPZVLOCGRP-UHFFFAOYSA-M
InChI=1S/C9H14N.CHF3O3S/c1-2-3-7-10-8-5-4-6-9-10;2-1(3,4)8(5,6)7/h4-6,8-9H,2-3,7H2,1H3;(H,5,6,7)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C9H14N
Molecular Weight 136.2142
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula CF3O3S
Molecular Weight 149.069
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:57:27 UTC 2023
Edited
by admin
on Sat Dec 16 08:57:27 UTC 2023
Record UNII
OZV73JH9EF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-BUTYLPYRIDINIUM TRIFLATE
Systematic Name English
N-BUTYLPYRIDINIUM TRIFLATE
Systematic Name English
PYRIDINIUM, 1-BUTYL-, TRIFLUOROMETHANESULFONATE (1:1)
Systematic Name English
1-BUTYLPYRIDINIUM TRIFLUOROMETHANESULFONATE
Systematic Name English
Code System Code Type Description
PUBCHEM
2734248
Created by admin on Sat Dec 16 08:57:27 UTC 2023 , Edited by admin on Sat Dec 16 08:57:27 UTC 2023
PRIMARY
CAS
390423-43-5
Created by admin on Sat Dec 16 08:57:27 UTC 2023 , Edited by admin on Sat Dec 16 08:57:27 UTC 2023
PRIMARY
FDA UNII
OZV73JH9EF
Created by admin on Sat Dec 16 08:57:27 UTC 2023 , Edited by admin on Sat Dec 16 08:57:27 UTC 2023
PRIMARY
EPA CompTox
DTXSID4049292
Created by admin on Sat Dec 16 08:57:27 UTC 2023 , Edited by admin on Sat Dec 16 08:57:27 UTC 2023
PRIMARY
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