CID 21896169

Dipropylene glycol methyl ether acetate

Structural Information

Molecular Formula
C9H18O4
SMILES
CC(COC(C)COC(=O)C)OC
InChI
InChI=1S/C9H18O4/c1-7(11-4)5-12-8(2)6-13-9(3)10/h7-8H,5-6H2,1-4H3
InChIKey
DRLRGHZJOQGQEC-UHFFFAOYSA-N
Compound name
2-(2-methoxypropoxy)propyl acetate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

21277
Patents

190.12051 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.12779 143.7
[M+Na]+ 213.10973 149.3
[M-H]- 189.11323 143.7
[M+NH4]+ 208.15433 163.3
[M+K]+ 229.08367 151.1
[M+H-H2O]+ 173.11777 138.5
[M+HCOO]- 235.11871 164.8
[M+CH3COO]- 249.13436 185.2
[M+Na-2H]- 211.09518 145.5
[M]+ 190.11996 149.3
[M]- 190.12106 149.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe