CID 85762826

2402829-62-1

Structural Information

Molecular Formula
C8H19N3O
SMILES
CN(C)CCCNC(=O)N(C)C
InChI
InChI=1S/C8H19N3O/c1-10(2)7-5-6-9-8(12)11(3)4/h5-7H2,1-4H3,(H,9,12)
InChIKey
WTKUDVAZHNXRTC-UHFFFAOYSA-N
Compound name
3-[3-(dimethylamino)propyl]-1,1-dimethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

173.15282 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.16010 142.4
[M+Na]+ 196.14204 149.3
[M+NH4]+ 191.18664 149.3
[M+K]+ 212.11598 145.3
[M-H]- 172.14554 143.2
[M+Na-2H]- 194.12749 145.4
[M]+ 173.15227 143.1
[M]- 173.15337 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

patents stripe