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Details

Stereochemistry ACHIRAL
Molecular Formula C9H20N.Br
Molecular Weight 222.166
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BUTYL-1-METHYLPYRROLIDINIUM BROMIDE

SMILES

[Br-].CCCC[N+]1(C)CCCC1

InChI

InChIKey=LCZRPQGSMFXSTC-UHFFFAOYSA-M
InChI=1S/C9H20N.BrH/c1-3-4-7-10(2)8-5-6-9-10;/h3-9H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H20N
Molecular Weight 142.2618
Charge 1
Count
Stereochemistry RACEMIC
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 08:52:30 UTC 2023
Edited
by admin
on Sat Dec 16 08:52:30 UTC 2023
Record UNII
F2F21K33C1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-BUTYL-1-METHYLPYRROLIDINIUM BROMIDE
Systematic Name English
N-BUTYL-N-METHYLPYRROLIDINIUM BROMIDE
Systematic Name English
PYRROLIDINIUM, 1-BUTYL-1-METHYL-, BROMIDE (1:1)
Systematic Name English
N-METHYL-N-BUTYLPYRROLIDINIUM BROMIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID4049375
Created by admin on Sat Dec 16 08:52:30 UTC 2023 , Edited by admin on Sat Dec 16 08:52:30 UTC 2023
PRIMARY
FDA UNII
F2F21K33C1
Created by admin on Sat Dec 16 08:52:30 UTC 2023 , Edited by admin on Sat Dec 16 08:52:30 UTC 2023
PRIMARY
PUBCHEM
11009532
Created by admin on Sat Dec 16 08:52:30 UTC 2023 , Edited by admin on Sat Dec 16 08:52:30 UTC 2023
PRIMARY
CAS
93457-69-3
Created by admin on Sat Dec 16 08:52:30 UTC 2023 , Edited by admin on Sat Dec 16 08:52:30 UTC 2023
PRIMARY
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