CID 12639037

Diethyl({2-[(propan-2-yl)amino]ethyl})amine

Structural Information

Molecular Formula
C9H22N2
SMILES
CCN(CC)CCNC(C)C
InChI
InChI=1S/C9H22N2/c1-5-11(6-2)8-7-10-9(3)4/h9-10H,5-8H2,1-4H3
InChIKey
SRYCFYOMSLPFBO-UHFFFAOYSA-N
Compound name
N',N'-diethyl-N-propan-2-ylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

132
Patents

158.1783 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.185576 141.8
[M+Na]+ 181.167518 146.0
[M-H]- 157.171024 143.0
[M+NH4]+ 176.212123 162.9
[M+K]+ 197.141458 146.8
[M+H-H2O]+ 141.175560 135.8
[M+HCOO]- 203.176501 166.1
[M+CH3COO]- 217.192151 190.4
[M+Na-2H]- 179.152966 145.5
[M]+ 158.17775142 143.1
[M]- 158.17884858 143.1
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

patents stripe