CID 445281

(3s)-2,3,4,5-tetrahydropyridin-3-amine

Structural Information

Molecular Formula
C5H10N2
SMILES
C1C[C@H](CN=C1)N
InChI
InChI=1S/C5H10N2/c6-5-2-1-3-7-4-5/h3,5H,1-2,4,6H2/t5-/m1/s1
InChIKey
SEECZTVWJNGUEJ-RXMQYKEDSA-N
Compound name
(3R)-2,3,4,5-tetrahydropyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

98.0844 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.091676 118.2
[M+Na]+ 121.073618 124.4
[M-H]- 97.077124 119.6
[M+NH4]+ 116.118223 139.4
[M+K]+ 137.047558 123.5
[M+H-H2O]+ 81.081660 112.1
[M+HCOO]- 143.082601 140.3
[M+CH3COO]- 157.098251 166.6
[M+Na-2H]- 119.059066 125.9
[M]+ 98.08385142 112.5
[M]- 98.08494858 112.5
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.