CID 237179

1,2,3,4,5,6-hexamethoxycyclohexane

Structural Information

Molecular Formula
C12H24O6
SMILES
COC1C(C(C(C(C1OC)OC)OC)OC)OC
InChI
InChI=1S/C12H24O6/c1-13-7-8(14-2)10(16-4)12(18-6)11(17-5)9(7)15-3/h7-12H,1-6H3
InChIKey
HQIAQQCYNCTUPJ-UHFFFAOYSA-N
Compound name
1,2,3,4,5,6-hexamethoxycyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

264.1573 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.164576 156.7
[M+Na]+ 287.146518 163.9
[M-H]- 263.150024 160.4
[M+NH4]+ 282.191123 174.3
[M+K]+ 303.120458 165.5
[M+H-H2O]+ 247.154560 150.9
[M+HCOO]- 309.155501 177.2
[M+CH3COO]- 323.171151 199.9
[M+Na-2H]- 285.131966 157.6
[M]+ 264.15675142 164.3
[M]- 264.15784858 164.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe