CID 20069912

2-(3,3,4-trimethylpiperazin-1-yl)ethan-1-amine

Structural Information

Molecular Formula
C9H21N3
SMILES
CC1(CN(CCN1C)CCN)C
InChI
InChI=1S/C9H21N3/c1-9(2)8-12(5-4-10)7-6-11(9)3/h4-8,10H2,1-3H3
InChIKey
QGDXSTUNWAZMAF-UHFFFAOYSA-N
Compound name
2-(3,3,4-trimethylpiperazin-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

171.17355 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.18083 141.2
[M+Na]+ 194.16277 151.3
[M+NH4]+ 189.20737 150.4
[M+K]+ 210.13671 143.6
[M-H]- 170.16627 142.5
[M+Na-2H]- 192.14822 146.7
[M]+ 171.17300 142.9
[M]- 171.17410 142.9
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