CID 216102

37109-12-9

Structural Information

Molecular Formula
C19H24N2O3S
SMILES
CN(CCN1CCOCC1)C(=O)C(C2=CC=CC=C2)(C3=CC=CS3)O
InChI
InChI=1S/C19H24N2O3S/c1-20(9-10-21-11-13-24-14-12-21)18(22)19(23,17-8-5-15-25-17)16-6-3-2-4-7-16/h2-8,15,23H,9-14H2,1H3
InChIKey
WHPOSSJOOGODIM-UHFFFAOYSA-N
Compound name
2-hydroxy-N-methyl-N-(2-morpholin-4-ylethyl)-2-phenyl-2-thiophen-2-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.15076 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.15804 184.8
[M+Na]+ 383.13998 187.0
[M-H]- 359.14348 192.6
[M+NH4]+ 378.18458 195.7
[M+K]+ 399.11392 185.0
[M+H-H2O]+ 343.14802 176.4
[M+HCOO]- 405.14896 196.9
[M+CH3COO]- 419.16461 211.7
[M+Na-2H]- 381.12543 185.0
[M]+ 360.15021 184.2
[M]- 360.15131 184.2
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.