CID 57881411

N-cyclopropylpropane-2-sulfonamide

Structural Information

Molecular Formula
C6H13NO2S
SMILES
CC(C)S(=O)(=O)NC1CC1
InChI
InChI=1S/C6H13NO2S/c1-5(2)10(8,9)7-6-3-4-6/h5-7H,3-4H2,1-2H3
InChIKey
QMBPZIBISGBCEF-UHFFFAOYSA-N
Compound name
N-cyclopropylpropane-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

163.0667 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.073976 130.2
[M+Na]+ 186.055918 138.7
[M-H]- 162.059424 134.9
[M+NH4]+ 181.100523 146.2
[M+K]+ 202.029858 136.3
[M+H-H2O]+ 146.063960 124.4
[M+HCOO]- 208.064901 148.2
[M+CH3COO]- 222.080551 181.0
[M+Na-2H]- 184.041366 134.4
[M]+ 163.06615142 134.2
[M]- 163.06724858 134.2
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