CID 7350

97-84-7

Structural Information

Molecular Formula
C8H20N2
SMILES
CC(CCN(C)C)N(C)C
InChI
InChI=1S/C8H20N2/c1-8(10(4)5)6-7-9(2)3/h8H,6-7H2,1-5H3
InChIKey
AXFVIWBTKYFOCY-UHFFFAOYSA-N
Compound name
1-N,1-N,3-N,3-N-tetramethylbutane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

3
References

9595
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 137.0
[M+Na]+ 167.151858 141.8
[M-H]- 143.155364 139.9
[M+NH4]+ 162.196463 159.4
[M+K]+ 183.125798 144.3
[M+H-H2O]+ 127.159900 131.1
[M+HCOO]- 189.160841 162.1
[M+CH3COO]- 203.176491 191.0
[M+Na-2H]- 165.137306 140.6
[M]+ 144.16209142 139.3
[M]- 144.16318858 139.3
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