CID 210037

Benzamide, n,n-diethyl-p-(isopropylsulfonyl)-

Structural Information

Molecular Formula
C14H21NO3S
SMILES
CCN(CC)C(=O)C1=CC=C(C=C1)S(=O)(=O)C(C)C
InChI
InChI=1S/C14H21NO3S/c1-5-15(6-2)14(16)12-7-9-13(10-8-12)19(17,18)11(3)4/h7-11H,5-6H2,1-4H3
InChIKey
YYVRGQJIOQHGEO-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-propan-2-ylsulfonylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.1242 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.13148 165.7
[M+Na]+ 306.11342 174.8
[M+NH4]+ 301.15802 172.0
[M+K]+ 322.08736 168.9
[M-H]- 282.11692 166.3
[M+Na-2H]- 304.09887 169.7
[M]+ 283.12365 167.4
[M]- 283.12475 167.4
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.