CID 10866337

2-(prop-2-en-1-yl)oxane

Structural Information

Molecular Formula
C8H14O
SMILES
C=CCC1CCCCO1
InChI
InChI=1S/C8H14O/c1-2-5-8-6-3-4-7-9-8/h2,8H,1,3-7H2
InChIKey
SJLROWLNDRDYCL-UHFFFAOYSA-N
Compound name
2-prop-2-enyloxane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

89
Patents

126.10446 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.11174 127.4
[M+Na]+ 149.09368 138.9
[M+NH4]+ 144.13828 136.8
[M+K]+ 165.06762 132.3
[M-H]- 125.09718 131.0
[M+Na-2H]- 147.07913 132.8
[M]+ 126.10391 130.0
[M]- 126.10501 130.0
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

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