CID 277900

18708-18-4

Structural Information

Molecular Formula

C₁₂H₁₂N₂O₃S

SMILES

CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=CO2

InChI

InChI=1S/C12H12N2O3S/c1-10-4-6-12(7-5-10)18(15,16)14-13-9-11-3-2-8-17-11/h2-9,14H,1H3

InChIKey

QHAQHUCZLYGDLT-UHFFFAOYSA-N

Compound name

N-(furan-2-ylmethylideneamino)-4-methylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 6
Patents: 264.05685 Da
Monoisotopic Mass: 2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	265.06413	158.5
[M+Na]+	287.04607	169.2
[M+NH4]+	282.09067	165.8
[M+K]+	303.02001	163.7
[M-H]-	263.04957	163.3
[M+Na-2H]-	285.03152	165.4
[M]+	264.05630	161.7
[M]-	264.05740	161.7

Literature stripe

literature stripe

Patent stripe

patents stripe