CID 68859160

1-cyanocyclopropane-1-sulfonamide

Structural Information

Molecular Formula
C4H6N2O2S
SMILES
C1CC1(C#N)S(=O)(=O)N
InChI
InChI=1S/C4H6N2O2S/c5-3-4(1-2-4)9(6,7)8/h1-2H2,(H2,6,7,8)
InChIKey
FEVQHSPHSYONQD-UHFFFAOYSA-N
Compound name
1-cyanocyclopropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

146.015 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.022276 130.4
[M+Na]+ 169.004218 146.3
[M-H]- 145.007724 137.3
[M+NH4]+ 164.048823 148.7
[M+K]+ 184.978158 141.9
[M+H-H2O]+ 129.012260 122.7
[M+HCOO]- 191.013201 147.6
[M+CH3COO]- 205.028851 187.3
[M+Na-2H]- 166.989666 138.0
[M]+ 146.01445142 130.6
[M]- 146.01554858 130.6
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

patents stripe