CID 98933

1,2,4-trimethylpiperazine

Structural Information

Molecular Formula
C7H16N2
SMILES
CC1CN(CCN1C)C
InChI
InChI=1S/C7H16N2/c1-7-6-8(2)4-5-9(7)3/h7H,4-6H2,1-3H3
InChIKey
UAIVFDJJMVMUGY-UHFFFAOYSA-N
Compound name
1,2,4-trimethylpiperazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1157
Patents

128.13135 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 129.2
[M+Na]+ 151.12057 141.1
[M+NH4]+ 146.16517 137.9
[M+K]+ 167.09451 134.9
[M-H]- 127.12407 130.6
[M+Na-2H]- 149.10602 134.4
[M]+ 128.13080 131.2
[M]- 128.13190 131.2
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

patents stripe