CID 65958198

N-(prop-2-yn-1-yl)azetidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C6H10N2
SMILES
C#CCNC1CNC1
InChI
InChI=1S/C6H10N2/c1-2-3-8-6-4-7-5-6/h1,6-8H,3-5H2
InChIKey
IXWZKOGXWYCWTH-UHFFFAOYSA-N
Compound name
N-prop-2-ynylazetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

110.0844 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.091676 118.3
[M+Na]+ 133.073618 124.7
[M-H]- 109.077124 117.8
[M+NH4]+ 128.118223 130.6
[M+K]+ 149.047558 126.6
[M+H-H2O]+ 93.081660 102.1
[M+HCOO]- 155.082601 133.4
[M+CH3COO]- 169.098251 181.1
[M+Na-2H]- 131.059066 124.4
[M]+ 110.08385142 117.1
[M]- 110.08494858 117.1
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.