NSC76180
Molecular Formula:
C
15
H
20
N
4
O
9
InChI:
InChI=1/C9H17NO2.C6H3N3O7/c1-10-6-2-3-8(10)7(5-11)9(12)4-6;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h6-9,11-12H,2-5H2,1H3;1-2,10H
InChIKey:
InChIKey=DKCDAEFNBWICFK-UHFFFAOYAZ
SMILES:
CN1C2CCC1C(C(C2)O)CO.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Names:
NSC76180
2-(hydroxymethyl)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol; 2,4,6-trinitrophenol
Registries:
PubChem CID 253337
PubChem ID 117478