CAS Registry Number®
81-14-1
CAS Name
Musk ketone
Molecular Formula
C14H18N2O5
Molecular Mass
294.30
Other Names and Identifiers
InChI
InChI=1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3
InChIKey
InChIKey=WXCMHFPAUCOJIG-UHFFFAOYSA-N
SMILES
C(C)(C)(C)C1=C(N(=O)=O)C(C)=C(C(C)=O)C(C)=C1N(=O)=O
Canonical SMILES
O=C(C=1C(=C(C(=C(C1C)N(=O)=O)C(C)(C)C)N(=O)=O)C)C
Other Names for this Substance
- Ethanone, 1-[4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]-
- Acetophenone, 4′-tert-butyl-2′,6′-dimethyl-3′,5′-dinitro-
- 1-[4-(1,1-Dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]ethanone
- 4-Aceto-3,5-dimethyl-2,6-dinitro-tert-butylbenzene
- 4′-tert-Butyl-2′,6′-dimethyl-3′,5′-dinitroacetophenone
- Musk ketone
- 3,5-Dinitro-4-tert-butyl-2,6-dimethylacetophenone
- 3,5-Dinitro-2,6-dimethyl-4-tert-butylacetophenone
- 2,6 Dimethyl-4-tert-butyl-3,5-dinitroacetophenone
- 4-tert-Butyl-2,6-dimethyl-3,5-dinitroacetophenone
- 2,6-Dimethyl-3,5-dinitro-4-tert-butyl acetophenone
- NSC 15339
- 1-tert-Butyl-3,5-dimethyl-2,6-dinitro-4-acetylbenzene
- 1-(4-(tert-Butyl)-2,6-dimethyl-3,5-dinitrophenyl)ethan-1-one
- 1-(4-tert-Butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone
- 1-(4-tert-Butyl-2,6-dimethyl-3,5-dinitrophenyl)ethan-1-one
