CID 3085612

2,5,7,10-tetraoxaundecane, 6-propyl-

Structural Information

Molecular Formula
C10H22O4
SMILES
CCCC(OCCOC)OCCOC
InChI
InChI=1S/C10H22O4/c1-4-5-10(13-8-6-11-2)14-9-7-12-3/h10H,4-9H2,1-3H3
InChIKey
QDZDGTWAADXFLM-UHFFFAOYSA-N
Compound name
1,1-bis(2-methoxyethoxy)butane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

206.15181 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.159086 149.4
[M+Na]+ 229.141028 154.6
[M-H]- 205.144534 148.9
[M+NH4]+ 224.185633 168.5
[M+K]+ 245.114968 155.7
[M+H-H2O]+ 189.149070 143.6
[M+HCOO]- 251.150011 171.8
[M+CH3COO]- 265.165661 188.0
[M+Na-2H]- 227.126476 153.1
[M]+ 206.15126142 157.4
[M]- 206.15235858 157.4
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