CID 11116191

2-(prop-2-yn-1-yl)pyrrolidine

Structural Information

Molecular Formula
C7H11N
SMILES
C#CCC1CCCN1
InChI
InChI=1S/C7H11N/c1-2-4-7-5-3-6-8-7/h1,7-8H,3-6H2
InChIKey
IQRIESRXVGDQDQ-UHFFFAOYSA-N
Compound name
2-prop-2-ynylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

109.08915 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.09643 125.3
[M+Na]+ 132.07837 135.2
[M+NH4]+ 127.12297 130.4
[M+K]+ 148.05231 127.7
[M-H]- 108.08187 118.0
[M+Na-2H]- 130.06382 127.0
[M]+ 109.08860 123.6
[M]- 109.08970 123.6
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

patents stripe