Coenzyme Q1
C14H18O4
727-81-1 Copyright (C) 2023 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  18 18 0 0 0
M  V30 BEGIN ATOM
M  V30 1 O 2.3100 1.3338 0.0 0
M  V30 2 C 3.0800 0.0000 0.0 0
M  V30 3 O 0.7700 4.0011 0.0 0
M  V30 4 C 0.0000 5.3348 0.0 0
M  V30 5 O 5.3901 1.3338 0.0 0
M  V30 6 O 2.3100 6.6686 0.0 0
M  V30 7 C 6.9301 4.0011 0.0 0
M  V30 8 C 7.7001 5.3348 0.0 0
M  V30 9 C 9.2401 5.3348 0.0 0
M  V30 10 C 10.0101 4.0011 0.0 0
M  V30 11 C 10.0101 6.6686 0.0 0
M  V30 12 C 5.3901 6.6686 0.0 0
M  V30 13 C 3.0800 2.6675 0.0 0
M  V30 14 C 2.3100 4.0011 0.0 0
M  V30 15 C 4.6201 2.6675 0.0 0
M  V30 16 C 3.0800 5.3348 0.0 0
M  V30 17 C 5.3901 4.0011 0.0 0
M  V30 18 C 4.6201 5.3348 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 13
M  V30 3 1 3 4
M  V30 4 1 3 14
M  V30 5 2 5 15
M  V30 6 2 6 16
M  V30 7 1 7 8
M  V30 8 1 7 17
M  V30 9 2 8 9
M  V30 10 1 9 10
M  V30 11 1 9 11
M  V30 12 1 12 18
M  V30 13 2 13 14
M  V30 14 1 13 15
M  V30 15 1 14 16
M  V30 16 1 15 17
M  V30 17 1 16 18
M  V30 18 2 17 18
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
727-81-1

> <cas.index.name>
2,5-Cyclohexadiene-1,4-dione, 2,3-dimethoxy-5-methyl-6-(3-methyl-2-buten-1-yl)-

> <molecular.formula>
C14H18O4

> <molecular.weight>
250.29

> <boiling.point.predicted>
389.1±42.0 °C    Press: 760 Torr

> <density.predicted>
1.10±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

$$$$
