CID 146049232

2411180-24-8

Structural Information

Molecular Formula
C8H13N
SMILES
C[C@@]1(CCCN1C)C#C
InChI
InChI=1S/C8H13N/c1-4-8(2)6-5-7-9(8)3/h1H,5-7H2,2-3H3/t8-/m0/s1
InChIKey
VDQYLHYDLRRNLY-QMMMGPOBSA-N
Compound name
(2R)-2-ethynyl-1,2-dimethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

123.1048 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.11208 124.0
[M+Na]+ 146.09402 134.5
[M-H]- 122.09752 125.1
[M+NH4]+ 141.13862 146.3
[M+K]+ 162.06796 131.0
[M+H-H2O]+ 106.10206 113.0
[M+HCOO]- 168.10300 140.1
[M+CH3COO]- 182.11865 180.2
[M+Na-2H]- 144.07947 128.5
[M]+ 123.10425 116.9
[M]- 123.10535 116.9
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.