CID 86547

Einecs 241-361-6

Structural Information

Molecular Formula
C8H18N2
SMILES
CC(C=CN(C)C)N(C)C
InChI
InChI=1S/C8H18N2/c1-8(10(4)5)6-7-9(2)3/h6-8H,1-5H3
InChIKey
DOJGJJJBWVDGTJ-UHFFFAOYSA-N
Compound name
1-N,1-N,3-N,3-N-tetramethylbut-1-ene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

7
Patents

142.147 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.15428 135.5
[M+Na]+ 165.13622 140.7
[M-H]- 141.13972 138.6
[M+NH4]+ 160.18082 158.0
[M+K]+ 181.11016 142.6
[M+H-H2O]+ 125.14426 129.8
[M+HCOO]- 187.14520 160.9
[M+CH3COO]- 201.16085 189.3
[M+Na-2H]- 163.12167 139.1
[M]+ 142.14645 137.0
[M]- 142.14755 137.0
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