CID 281888

Glycidyl propargyl ether

Structural Information

Molecular Formula
C6H8O2
SMILES
C#CCOCC1CO1
InChI
InChI=1S/C6H8O2/c1-2-3-7-4-6-5-8-6/h1,6H,3-5H2
InChIKey
SYFZCLMMUNCHNH-UHFFFAOYSA-N
Compound name
2-(prop-2-ynoxymethyl)oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

980
Patents

112.05243 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.05971 114.3
[M+Na]+ 135.04165 130.1
[M-H]- 111.04515 120.3
[M+NH4]+ 130.08625 131.1
[M+K]+ 151.01559 126.7
[M+H-H2O]+ 95.049690 105.4
[M+HCOO]- 157.05063 134.4
[M+CH3COO]- 171.06628 180.8
[M+Na-2H]- 133.02710 124.4
[M]+ 112.05188 116.0
[M]- 112.05298 116.0
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

patents stripe