CID 81584182

2094140-62-0

Structural Information

Molecular Formula
C10H14N6O2S
SMILES
CC(C1=CC=C(C=C1)S(=O)(=O)NC2=NN(N=N2)C)N
InChI
InChI=1S/C10H14N6O2S/c1-7(11)8-3-5-9(6-4-8)19(17,18)14-10-12-15-16(2)13-10/h3-7H,11H2,1-2H3,(H,13,14)
InChIKey
RJIATGDSRLTEKF-UHFFFAOYSA-N
Compound name
4-(1-aminoethyl)-N-(2-methyltetrazol-5-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.0899 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.09718 162.3
[M+Na]+ 305.07912 171.5
[M-H]- 281.08262 164.7
[M+NH4]+ 300.12372 174.4
[M+K]+ 321.05306 167.4
[M+H-H2O]+ 265.08716 153.7
[M+HCOO]- 327.08810 178.1
[M+CH3COO]- 341.10375 200.3
[M+Na-2H]- 303.06457 165.4
[M]+ 282.08935 163.6
[M]- 282.09045 163.6
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

No patent data available for this compound.