Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C8H10O
Datos Químicos de C8H10O
ID
62596
Molecular Scaffold
dnT@@DjUcDHjijjji`dQIbIU@@
Molecular Formula
C8H10O
Elemental Composition %
C: 42.1052631578947%
H: 52.6315789473684%
O: 5.26315789473684%
N: 0%
Weight
122.166
Programa de Cálculo
G16
SMILES
C[C@]1([C@H]2[C@@H]3[C@H]2[C@@H]2[C@H]1[C@H]23)O
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C8H10O/c1-8(9)6-2-3(6)5-4(2)7(5)8/h2-7,9H,1H3
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
GKWXNFFCNXFLTH-UHFFFAOYSA-N