CID 130522145

[(2s)-2-aminopentyl](ethyl)amine

Structural Information

Molecular Formula
C7H18N2
SMILES
CCC[C@@H](CNCC)N
InChI
InChI=1S/C7H18N2/c1-3-5-7(8)6-9-4-2/h7,9H,3-6,8H2,1-2H3/t7-/m0/s1
InChIKey
MXKSSOXEWRLPCN-ZETCQYMHSA-N
Compound name
(2S)-1-N-ethylpentane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

130.147 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.154276 132.5
[M+Na]+ 153.136218 137.4
[M-H]- 129.139724 132.1
[M+NH4]+ 148.180823 153.8
[M+K]+ 169.110158 136.9
[M+H-H2O]+ 113.144260 127.1
[M+HCOO]- 175.145201 156.3
[M+CH3COO]- 189.160851 180.1
[M+Na-2H]- 151.121666 137.0
[M]+ 130.14645142 130.8
[M]- 130.14754858 130.8
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.