CID 165785318

3-(dimethylamino)-n-methyl-n-(prop-2-yn-1-yl)propanamide

Structural Information

Molecular Formula
C9H16N2O
SMILES
CN(C)CCC(=O)N(C)CC#C
InChI
InChI=1S/C9H16N2O/c1-5-7-11(4)9(12)6-8-10(2)3/h1H,6-8H2,2-4H3
InChIKey
QKUNDVLNCFCKRP-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-N-methyl-N-prop-2-ynylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.12627 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.13355 140.2
[M+Na]+ 191.11549 148.5
[M+NH4]+ 186.16009 144.0
[M+K]+ 207.08943 141.1
[M-H]- 167.11899 132.9
[M+Na-2H]- 189.10094 140.8
[M]+ 168.12572 138.2
[M]- 168.12682 138.2
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.