CID 54932

Brn 5732711

Structural Information

Molecular Formula
C10H18N2O
SMILES
CC(C#CCN(C)C)N(C)C(=O)C
InChI
InChI=1S/C10H18N2O/c1-9(12(5)10(2)13)7-6-8-11(3)4/h9H,8H2,1-5H3
InChIKey
SNJASRAPXUQFBR-UHFFFAOYSA-N
Compound name
N-[5-(dimethylamino)pent-3-yn-2-yl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.1419 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.14918 144.4
[M+Na]+ 205.13112 152.3
[M+NH4]+ 200.17572 147.9
[M+K]+ 221.10506 145.3
[M-H]- 181.13462 136.8
[M+Na-2H]- 203.11657 144.4
[M]+ 182.14135 142.2
[M]- 182.14245 142.2
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.