CID 66466907

2219353-47-4

Structural Information

Molecular Formula
C7H11N
SMILES
CC1(CCCN1)C#C
InChI
InChI=1S/C7H11N/c1-3-7(2)5-4-6-8-7/h1,8H,4-6H2,2H3
InChIKey
ZQZMGGHFOQLPDL-UHFFFAOYSA-N
Compound name
2-ethynyl-2-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

109.08915 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.096426 123.2
[M+Na]+ 132.078368 132.9
[M-H]- 108.081874 122.8
[M+NH4]+ 127.122973 145.0
[M+K]+ 148.052308 128.7
[M+H-H2O]+ 92.086410 112.2
[M+HCOO]- 154.087351 138.2
[M+CH3COO]- 168.103001 174.1
[M+Na-2H]- 130.063816 128.1
[M]+ 109.08860142 113.7
[M]- 109.08969858 113.7
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

No patent data available for this compound.