CID 28599421

302800-26-6

Structural Information

Molecular Formula
C8H20N2
SMILES
CC(C)C[C@@H](CN(C)C)N
InChI
InChI=1S/C8H20N2/c1-7(2)5-8(9)6-10(3)4/h7-8H,5-6,9H2,1-4H3/t8-/m0/s1
InChIKey
SYGGWSCXCCJJFT-QMMMGPOBSA-N
Compound name
(2S)-1-N,1-N,4-trimethylpentane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

144.16264 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.169916 138.1
[M+Na]+ 167.151858 142.5
[M-H]- 143.155364 139.1
[M+NH4]+ 162.196463 159.5
[M+K]+ 183.125798 143.7
[M+H-H2O]+ 127.159900 132.4
[M+HCOO]- 189.160841 161.1
[M+CH3COO]- 203.176491 187.5
[M+Na-2H]- 165.137306 140.0
[M]+ 144.16209142 137.4
[M]- 144.16318858 137.4
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

patents stripe