CID 67958833

2,4-bis(methoxymethoxy)-1-methylbenzene

Structural Information

Molecular Formula
C11H16O4
SMILES
CC1=C(C=C(C=C1)OCOC)OCOC
InChI
InChI=1S/C11H16O4/c1-9-4-5-10(14-7-12-2)6-11(9)15-8-13-3/h4-6H,7-8H2,1-3H3
InChIKey
KATRHCAFHCZCFA-UHFFFAOYSA-N
Compound name
2,4-bis(methoxymethoxy)-1-methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

72
Patents

212.10486 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.11214 144.4
[M+Na]+ 235.09408 152.6
[M-H]- 211.09758 148.3
[M+NH4]+ 230.13868 163.6
[M+K]+ 251.06802 152.5
[M+H-H2O]+ 195.10212 138.1
[M+HCOO]- 257.10306 169.2
[M+CH3COO]- 271.11871 187.7
[M+Na-2H]- 233.07953 150.2
[M]+ 212.10431 151.7
[M]- 212.10541 151.7
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