CID 3084810

Formamide, n,n'-[(methylimino)di-3,1-propanediyl]bis-

Structural Information

Molecular Formula
C9H19N3O2
SMILES
CN(CCCNC=O)CCCNC=O
InChI
InChI=1S/C9H19N3O2/c1-12(6-2-4-10-8-13)7-3-5-11-9-14/h8-9H,2-7H2,1H3,(H,10,13)(H,11,14)
InChIKey
OYBJIUFXAWECLJ-UHFFFAOYSA-N
Compound name
N-[3-[3-formamidopropyl(methyl)amino]propyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

201.14772 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.154996 146.5
[M+Na]+ 224.136938 150.4
[M-H]- 200.140444 147.4
[M+NH4]+ 219.181543 165.2
[M+K]+ 240.110878 150.4
[M+H-H2O]+ 184.144980 139.4
[M+HCOO]- 246.145921 173.6
[M+CH3COO]- 260.161571 196.7
[M+Na-2H]- 222.122386 151.9
[M]+ 201.14717142 149.1
[M]- 201.14826858 149.1
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

patents stripe