CID 3031106

Niosh/ue3584000

Structural Information

Molecular Formula
C14H24N2OS
SMILES
CCC(=O)N(CC(C)N(CC)CC)C1=CC=CS1
InChI
InChI=1S/C14H24N2OS/c1-5-13(17)16(14-9-8-10-18-14)11-12(4)15(6-2)7-3/h8-10,12H,5-7,11H2,1-4H3
InChIKey
HDJUQWCCLSHCPS-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)propyl]-N-thiophen-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.16095 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.16823 166.8
[M+Na]+ 291.15017 173.6
[M+NH4]+ 286.19477 174.4
[M+K]+ 307.12411 168.4
[M-H]- 267.15367 169.0
[M+Na-2H]- 289.13562 170.1
[M]+ 268.16040 168.5
[M]- 268.16150 168.5
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.