CID 80020

N-[3-(dimethylamino)propyl]formamide

Structural Information

Molecular Formula
C6H14N2O
SMILES
CN(C)CCCNC=O
InChI
InChI=1S/C6H14N2O/c1-8(2)5-3-4-7-6-9/h6H,3-5H2,1-2H3,(H,7,9)
InChIKey
WFBDWTZOYPUBQZ-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]formamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

1006
Patents

130.11061 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.117886 128.5
[M+Na]+ 153.099828 134.4
[M-H]- 129.103334 130.1
[M+NH4]+ 148.144433 150.6
[M+K]+ 169.073768 135.3
[M+H-H2O]+ 113.107870 122.9
[M+HCOO]- 175.108811 155.2
[M+CH3COO]- 189.124461 181.4
[M+Na-2H]- 151.085276 135.2
[M]+ 130.11006142 130.1
[M]- 130.11115858 130.1
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