CID 23294

Di-sec-butyl ether

Structural Information

Molecular Formula

C₈H₁₈O

SMILES

CCC(C)OC(C)CC

InChI

InChI=1S/C8H18O/c1-5-7(3)9-8(4)6-2/h7-8H,5-6H2,1-4H3

InChIKey

HHBZZTKMMLDNDN-UHFFFAOYSA-N

Compound name

2-butan-2-yloxybutane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 5621
Patents: 130.13577 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	131.14305	130.5
[M+Na]+	153.12499	140.6
[M+NH4]+	148.16959	138.8
[M+K]+	169.09893	135.3
[M-H]-	129.12849	130.2
[M+Na-2H]-	151.11044	134.0
[M]+	130.13522	131.7
[M]-	130.13632	131.7

Literature stripe

literature stripe

Patent stripe

patents stripe