CID 177747094

N-methyl-1,2-diazaspiro[2.3]hex-1-en-5-amine hydrochloride

Structural Information

Molecular Formula
C5H9N3
SMILES
CNC1CC2(C1)N=N2
InChI
InChI=1S/C5H9N3/c1-6-4-2-5(3-4)7-8-5/h4,6H,2-3H2,1H3
InChIKey
BJWGHESVRLHDDI-UHFFFAOYSA-N
Compound name
N-methyl-1,2-diazaspiro[2.3]hex-1-en-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

111.07965 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.086926 127.3
[M+Na]+ 134.068868 136.9
[M-H]- 110.072374 131.8
[M+NH4]+ 129.113473 138.7
[M+K]+ 150.042808 138.2
[M+H-H2O]+ 94.076910 116.4
[M+HCOO]- 156.077851 149.7
[M+CH3COO]- 170.093501 177.6
[M+Na-2H]- 132.054316 137.1
[M]+ 111.07910142 137.3
[M]- 111.08019858 137.3
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.