CID 165502394

7-azidoheptane-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H14ClN3O2S
SMILES
C(CCCN=[N+]=[N-])CCCS(=O)(=O)Cl
InChI
InChI=1S/C7H14ClN3O2S/c8-14(12,13)7-5-3-1-2-4-6-10-11-9/h1-7H2
InChIKey
HAIBJMTVNOSXKS-UHFFFAOYSA-N
Compound name
7-azidoheptane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.04953 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.05681 151.7
[M+Na]+ 262.03875 158.1
[M-H]- 238.04225 154.3
[M+NH4]+ 257.08335 170.5
[M+K]+ 278.01269 150.2
[M+H-H2O]+ 222.04679 150.9
[M+HCOO]- 284.04773 170.9
[M+CH3COO]- 298.06338 190.2
[M+Na-2H]- 260.02420 158.4
[M]+ 239.04898 155.0
[M]- 239.05008 155.0
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.