CID 22094258

Bicyclo[2.2.1]hept-5-ene-2-sulfonamide

Structural Information

Molecular Formula
C7H11NO2S
SMILES
C1C2CC(C1C=C2)S(=O)(=O)N
InChI
InChI=1S/C7H11NO2S/c8-11(9,10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2,(H2,8,9,10)
InChIKey
GOUWTBUEZMTPKV-UHFFFAOYSA-N
Compound name
bicyclo[2.2.1]hept-5-ene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

173.05106 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.05834 136.4
[M+Na]+ 196.04028 145.6
[M-H]- 172.04378 139.6
[M+NH4]+ 191.08488 162.2
[M+K]+ 212.01422 143.5
[M+H-H2O]+ 156.04832 133.3
[M+HCOO]- 218.04926 154.3
[M+CH3COO]- 232.06491 176.9
[M+Na-2H]- 194.02573 139.8
[M]+ 173.05051 137.5
[M]- 173.05161 137.5
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