CID 9589299

126826-68-4

Structural Information

Molecular Formula
C14H21N3O2S
SMILES
CC/C(=N\S(=O)(=O)C1=CC=C(C=C1)N)/N2CCCCC2
InChI
InChI=1S/C14H21N3O2S/c1-2-14(17-10-4-3-5-11-17)16-20(18,19)13-8-6-12(15)7-9-13/h6-9H,2-5,10-11,15H2,1H3/b16-14+
InChIKey
FKYQYLAJEIGFCB-JQIJEIRASA-N
Compound name
(NE)-4-amino-N-(1-piperidin-1-ylpropylidene)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.13544 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.14272 167.5
[M+Na]+ 318.12466 171.7
[M-H]- 294.12816 172.6
[M+NH4]+ 313.16926 181.3
[M+K]+ 334.09860 167.9
[M+H-H2O]+ 278.13270 159.1
[M+HCOO]- 340.13364 182.4
[M+CH3COO]- 354.14929 204.0
[M+Na-2H]- 316.11011 169.4
[M]+ 295.13489 164.3
[M]- 295.13599 164.3
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

No patent data available for this compound.