CID 470076

2-[2-(tert-butylamino)ethylamino]butan-1-ol

Structural Information

Molecular Formula
C10H24N2O
SMILES
CCC(CO)NCCNC(C)(C)C
InChI
InChI=1S/C10H24N2O/c1-5-9(8-13)11-6-7-12-10(2,3)4/h9,11-13H,5-8H2,1-4H3
InChIKey
JNOOBOVDCYUEJT-UHFFFAOYSA-N
Compound name
2-[2-(tert-butylamino)ethylamino]butan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

188.18886 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.19614 149.3
[M+Na]+ 211.17808 153.0
[M-H]- 187.18158 147.7
[M+NH4]+ 206.22268 168.0
[M+K]+ 227.15202 152.0
[M+H-H2O]+ 171.18612 144.0
[M+HCOO]- 233.18706 170.0
[M+CH3COO]- 247.20271 188.9
[M+Na-2H]- 209.16353 153.4
[M]+ 188.18831 148.7
[M]- 188.18941 148.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.