CID 130971560

2-[(3r,5s)-3,4,5-trimethylpiperazin-1-yl]ethan-1-amine

Structural Information

Molecular Formula
C9H21N3
SMILES
C[C@@H]1CN(C[C@@H](N1C)C)CCN
InChI
InChI=1S/C9H21N3/c1-8-6-12(5-4-10)7-9(2)11(8)3/h8-9H,4-7,10H2,1-3H3/t8-,9+
InChIKey
NZNISCGMYQFKDL-DTORHVGOSA-N
Compound name
2-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.17355 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.18083 143.4
[M+Na]+ 194.16277 149.8
[M-H]- 170.16627 143.4
[M+NH4]+ 189.20737 161.3
[M+K]+ 210.13671 147.9
[M+H-H2O]+ 154.17081 136.3
[M+HCOO]- 216.17175 161.3
[M+CH3COO]- 230.18740 185.4
[M+Na-2H]- 192.14822 145.6
[M]+ 171.17300 139.4
[M]- 171.17410 139.4
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.