CID 16107790

911196-99-1

Structural Information

Molecular Formula
C14H17N5O2S
SMILES
CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCN=[N+]=[N-]
InChI
InChI=1S/C14H17N5O2S/c1-19(2)13-7-3-6-12-11(13)5-4-8-14(12)22(20,21)17-10-9-16-18-15/h3-8,17H,9-10H2,1-2H3
InChIKey
HVMWRNDGKJZUGJ-UHFFFAOYSA-N
Compound name
N-(2-azidoethyl)-5-(dimethylamino)naphthalene-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

319.1103 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.11758 166.9
[M+Na]+ 342.09952 177.5
[M+NH4]+ 337.14412 174.5
[M+K]+ 358.07346 171.4
[M-H]- 318.10302 172.9
[M+Na-2H]- 340.08497 174.2
[M]+ 319.10975 170.3
[M]- 319.11085 170.3
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