CID 91409

2-(1-ethoxyethoxy)propane

Structural Information

Molecular Formula
C7H16O2
SMILES
CCOC(C)OC(C)C
InChI
InChI=1S/C7H16O2/c1-5-8-7(4)9-6(2)3/h6-7H,5H2,1-4H3
InChIKey
QRYDGQLSWQAGGB-UHFFFAOYSA-N
Compound name
2-(1-ethoxyethoxy)propane
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

127
Patents

132.11504 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.122316 130.0
[M+Na]+ 155.104258 136.4
[M-H]- 131.107764 130.4
[M+NH4]+ 150.148863 152.2
[M+K]+ 171.078198 137.9
[M+H-H2O]+ 115.112300 125.5
[M+HCOO]- 177.113241 152.1
[M+CH3COO]- 191.128891 175.9
[M+Na-2H]- 153.089706 134.1
[M]+ 132.11449142 133.4
[M]- 132.11558858 133.4
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