CID 16788379

4-amino-n-(cyclopropylmethyl)benzenesulfonamide

Structural Information

Molecular Formula
C10H14N2O2S
SMILES
C1CC1CNS(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C10H14N2O2S/c11-9-3-5-10(6-4-9)15(13,14)12-7-8-1-2-8/h3-6,8,12H,1-2,7,11H2
InChIKey
XBXNGYRXFLXLHD-UHFFFAOYSA-N
Compound name
4-amino-N-(cyclopropylmethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

226.0776 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.08488 150.6
[M+Na]+ 249.06682 161.7
[M+NH4]+ 244.11142 158.8
[M+K]+ 265.04076 156.2
[M-H]- 225.07032 160.4
[M+Na-2H]- 247.05227 159.2
[M]+ 226.07705 156.3
[M]- 226.07815 156.3
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