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Details

Stereochemistry MIXED
Molecular Formula C10H10O3
Molecular Weight 178.1846
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,6-Tetrahydro methyl-3,6-methanophthalic anhydride

SMILES

CC1C2C=CC1C3C2C(=O)OC3=O

InChI

InChIKey=SBKPSHZVULRXED-UHFFFAOYSA-N
InChI=1S/C10H10O3/c1-4-5-2-3-6(4)8-7(5)9(11)13-10(8)12/h2-8H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3a,4,7,7a-Tetrahydro-8-methyl-4,7-methanoisobenzofuran-1,3-dione
Preferred Name English
1,2,3,6-Tetrahydro methyl-3,6-methanophthalic anhydride
Systematic Name English
4,7-Methanoisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydro-8-methyl-
Systematic Name English
Code System Code Type Description
FDA UNII
KW98SY7PSB
Created by admin on Wed Apr 02 09:15:12 GMT 2025 , Edited by admin on Wed Apr 02 09:15:12 GMT 2025
PRIMARY
PUBCHEM
20624593
Created by admin on Wed Apr 02 09:15:12 GMT 2025 , Edited by admin on Wed Apr 02 09:15:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID901002905
Created by admin on Wed Apr 02 09:15:12 GMT 2025 , Edited by admin on Wed Apr 02 09:15:12 GMT 2025
PRIMARY
CAS
828-66-0
Created by admin on Wed Apr 02 09:15:12 GMT 2025 , Edited by admin on Wed Apr 02 09:15:12 GMT 2025
PRIMARY
NIH
NCATS
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