U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H26O
Molecular Weight 198.3449
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Tridecanone

SMILES

CCCCCCCC(=O)CCCCC

InChI

InChIKey=KPVFRXPKBAAIIE-UHFFFAOYSA-N
InChI=1S/C13H26O/c1-3-5-7-8-10-12-13(14)11-9-6-4-2/h3-12H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C13H26O
Molecular Weight 198.3449
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 13:14:57 GMT 2023
Edited
by admin
on Sat Dec 16 13:14:57 GMT 2023
Record UNII
BX4NSZ89QX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-Tridecanone
Systematic Name English
8-Tridecanone
Systematic Name English
AI3-38184
Code English
NSC-158514
Code English
Tridecan-6-one
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
244-728-9
Created by admin on Sat Dec 16 13:14:57 GMT 2023 , Edited by admin on Sat Dec 16 13:14:57 GMT 2023
PRIMARY
CAS
22026-12-6
Created by admin on Sat Dec 16 13:14:57 GMT 2023 , Edited by admin on Sat Dec 16 13:14:57 GMT 2023
PRIMARY
PUBCHEM
89156
Created by admin on Sat Dec 16 13:14:57 GMT 2023 , Edited by admin on Sat Dec 16 13:14:57 GMT 2023
PRIMARY
FDA UNII
BX4NSZ89QX
Created by admin on Sat Dec 16 13:14:57 GMT 2023 , Edited by admin on Sat Dec 16 13:14:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID60176492
Created by admin on Sat Dec 16 13:14:57 GMT 2023 , Edited by admin on Sat Dec 16 13:14:57 GMT 2023
PRIMARY
NSC
158514
Created by admin on Sat Dec 16 13:14:57 GMT 2023 , Edited by admin on Sat Dec 16 13:14:57 GMT 2023
PRIMARY