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Details

Stereochemistry ACHIRAL
Molecular Formula C9H17NO
Molecular Weight 155.2374
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-ISOBUTYL-4-PIPERIDONE

SMILES

CC(C)CN1CCC(=O)CC1

InChI

InChIKey=KMTASGXMTBUSSP-UHFFFAOYSA-N
InChI=1S/C9H17NO/c1-8(2)7-10-5-3-9(11)4-6-10/h8H,3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H17NO
Molecular Weight 155.2374
Charge 0
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 11:58:20 UTC 2023
Edited
by admin
on Sat Dec 16 11:58:20 UTC 2023
Record UNII
WL7MDR2ZN2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-ISOBUTYL-4-PIPERIDONE
Systematic Name English
N-ISOBUTYL-4-PIPERIDINONE
Systematic Name English
RIFABUTIN IMPURITY A [EP IMPURITY]
Common Name English
1-(2-METHYLPROPYL)PIPERIDIN-4-ONE
Systematic Name English
1-(2-METHYLPROPYL)-4-PIPERIDINONE
Systematic Name English
1-(2-METHYLPROPYL)-4-PIPERIDONE
Systematic Name English
4-PIPERIDINONE, 1-(2-METHYLPROPYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
WL7MDR2ZN2
Created by admin on Sat Dec 16 11:58:20 UTC 2023 , Edited by admin on Sat Dec 16 11:58:20 UTC 2023
PRIMARY
PUBCHEM
4202451
Created by admin on Sat Dec 16 11:58:20 UTC 2023 , Edited by admin on Sat Dec 16 11:58:20 UTC 2023
PRIMARY
ECHA (EC/EINECS)
276-712-2
Created by admin on Sat Dec 16 11:58:20 UTC 2023 , Edited by admin on Sat Dec 16 11:58:20 UTC 2023
PRIMARY
EPA CompTox
DTXSID70222858
Created by admin on Sat Dec 16 11:58:20 UTC 2023 , Edited by admin on Sat Dec 16 11:58:20 UTC 2023
PRIMARY
CAS
72544-16-2
Created by admin on Sat Dec 16 11:58:20 UTC 2023 , Edited by admin on Sat Dec 16 11:58:20 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (TLC)
EP