CID 877246

3-(morpholine-4-sulfonyl)benzohydrazide

Structural Information

Molecular Formula
C11H15N3O4S
SMILES
C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NN
InChI
InChI=1S/C11H15N3O4S/c12-13-11(15)9-2-1-3-10(8-9)19(16,17)14-4-6-18-7-5-14/h1-3,8H,4-7,12H2,(H,13,15)
InChIKey
FWIFKKUOURUDNG-UHFFFAOYSA-N
Compound name
3-morpholin-4-ylsulfonylbenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

29
Patents

285.07834 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.085616 160.8
[M+Na]+ 308.067558 165.6
[M-H]- 284.071064 165.6
[M+NH4]+ 303.112163 172.7
[M+K]+ 324.041498 163.6
[M+H-H2O]+ 268.075600 152.8
[M+HCOO]- 330.076541 174.8
[M+CH3COO]- 344.092191 198.0
[M+Na-2H]- 306.053006 165.0
[M]+ 285.07779142 158.2
[M]- 285.07888858 158.2
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