CID 4369384

(2r)-2-{[(4-fluoro-3-methylphenyl)sulfonyl]amino}-n-hydroxy-2-tetrahydro-2h-pyran-4-ylacetamide

Structural Information

Molecular Formula
C14H19FN2O5S
SMILES
CC1=C(C=CC(=C1)S(=O)(=O)N[C@H](C2CCOCC2)C(=O)NO)F
InChI
InChI=1S/C14H19FN2O5S/c1-9-8-11(2-3-12(9)15)23(20,21)17-13(14(18)16-19)10-4-6-22-7-5-10/h2-3,8,10,13,17,19H,4-7H2,1H3,(H,16,18)/t13-/m1/s1
InChIKey
LUCFRFDOOYLALP-CYBMUJFWSA-N
Compound name
(2R)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-hydroxy-2-(oxan-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

19
Patents

346.09988 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.10716 174.5
[M+Na]+ 369.08910 177.6
[M-H]- 345.09260 178.1
[M+NH4]+ 364.13370 184.7
[M+K]+ 385.06304 175.6
[M+H-H2O]+ 329.09714 166.1
[M+HCOO]- 391.09808 185.9
[M+CH3COO]- 405.11373 209.7
[M+Na-2H]- 367.07455 176.0
[M]+ 346.09933 171.8
[M]- 346.10043 171.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe