CID 138176

Propane, 2,2'-[ethylidenebis(oxy)]bis-

Structural Information

Molecular Formula
C8H18O2
SMILES
CC(C)OC(C)OC(C)C
InChI
InChI=1S/C8H18O2/c1-6(2)9-8(5)10-7(3)4/h6-8H,1-5H3
InChIKey
TWWSMHPNERSWRN-UHFFFAOYSA-N
Compound name
2-(1-propan-2-yloxyethoxy)propane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1125
Patents

146.13068 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.13796 134.8
[M+Na]+ 169.11990 140.5
[M-H]- 145.12340 135.0
[M+NH4]+ 164.16450 156.3
[M+K]+ 185.09384 142.2
[M+H-H2O]+ 129.12794 130.1
[M+HCOO]- 191.12888 155.5
[M+CH3COO]- 205.14453 179.8
[M+Na-2H]- 167.10535 137.1
[M]+ 146.13013 137.8
[M]- 146.13123 137.8
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