CID 96680631

1-[(2s)-1-(prop-2-yn-1-yl)pyrrolidin-2-yl]methanamine dihydrochloride

Structural Information

Molecular Formula
C8H14N2
SMILES
C#CCN1CCC[C@@H]1CN
InChI
InChI=1S/C8H14N2/c1-2-5-10-6-3-4-8(10)7-9/h1,8H,3-7,9H2/t8-/m1/s1
InChIKey
MIJYJUOXVFSADM-MRVPVSSYSA-N
Compound name
[(2R)-1-prop-2-ynylpyrrolidin-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.11569 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.12297 130.0
[M+Na]+ 161.10491 138.4
[M-H]- 137.10841 129.8
[M+NH4]+ 156.14951 149.1
[M+K]+ 177.07885 135.1
[M+H-H2O]+ 121.11295 117.5
[M+HCOO]- 183.11389 146.1
[M+CH3COO]- 197.12954 184.1
[M+Na-2H]- 159.09036 132.5
[M]+ 138.11514 120.8
[M]- 138.11624 120.8
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.