CID 56730

94073-39-9

Structural Information

Molecular Formula
C10H25N4
SMILES
CC[N+](C)(CC)CCCCN=C(N)N
InChI
InChI=1S/C10H25N4/c1-4-14(3,5-2)9-7-6-8-13-10(11)12/h4-9H2,1-3H3,(H4,11,12,13)/q+1
InChIKey
DRCRMBPILRBXNT-UHFFFAOYSA-N
Compound name
4-(diaminomethylideneamino)butyl-diethyl-methylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.20792 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.21520 145.5
[M+Na]+ 224.19714 149.0
[M-H]- 200.20064 147.2
[M+NH4]+ 219.24174 164.4
[M+K]+ 240.17108 143.4
[M+H-H2O]+ 184.20518 141.9
[M+HCOO]- 246.20612 171.0
[M+CH3COO]- 260.22177 195.4
[M+Na-2H]- 222.18259 152.3
[M]+ 201.20737 143.1
[M]- 201.20847 143.1
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.