CID 146049232

(2r)-2-ethynyl-1,2-dimethylpyrrolidinehydrochloride

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
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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 124.9
[M+Na]+ 146.09402 135.6
[M+NH4]+ 141.13862 131.5
[M+K]+ 162.06796 126.7
[M-H]- 122.09752 118.1
[M+Na-2H]- 144.07947 128.4
[M]+ 123.10425 123.7
[M]- 123.10535 123.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.