CID 2318069

3-(pyrrolidine-1-sulfonyl)benzohydrazide

Structural Information

Molecular Formula
C11H15N3O3S
SMILES
C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN
InChI
InChI=1S/C11H15N3O3S/c12-13-11(15)9-4-3-5-10(8-9)18(16,17)14-6-1-2-7-14/h3-5,8H,1-2,6-7,12H2,(H,13,15)
InChIKey
JHVLVYXHBGGAFG-UHFFFAOYSA-N
Compound name
3-pyrrolidin-1-ylsulfonylbenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

269.0834 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.09068 158.3
[M+Na]+ 292.07262 165.4
[M+NH4]+ 287.11722 164.2
[M+K]+ 308.04656 162.1
[M-H]- 268.07612 159.6
[M+Na-2H]- 290.05807 162.6
[M]+ 269.08285 159.6
[M]- 269.08395 159.6
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

patents stripe