CID 528429

Tripropylene glycol monopropyl ether

Structural Information

Molecular Formula
C12H26O4
SMILES
CCCOCC(C)OCC(C)OCC(C)O
InChI
InChI=1S/C12H26O4/c1-5-6-14-8-11(3)16-9-12(4)15-7-10(2)13/h10-13H,5-9H2,1-4H3
InChIKey
JKEHLQXXZMANPK-UHFFFAOYSA-N
Compound name
1-[1-(1-propoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4903
Patents

234.1831 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.190376 160.1
[M+Na]+ 257.172318 163.6
[M-H]- 233.175824 158.0
[M+NH4]+ 252.216923 177.2
[M+K]+ 273.146258 164.3
[M+H-H2O]+ 217.180360 154.3
[M+HCOO]- 279.181301 178.4
[M+CH3COO]- 293.196951 193.0
[M+Na-2H]- 255.157766 159.6
[M]+ 234.18255142 165.6
[M]- 234.18364858 165.6
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