CID 40162

Brn 2254961

Structural Information

Molecular Formula
C9H19NO3S
SMILES
CCCN(CCC)C(=O)S(=O)(=O)CC
InChI
InChI=1S/C9H19NO3S/c1-4-7-10(8-5-2)9(11)14(12,13)6-3/h4-8H2,1-3H3
InChIKey
UFAJMCYNUQICRB-UHFFFAOYSA-N
Compound name
1-ethylsulfonyl-N,N-dipropylformamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.10857 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.11585 149.8
[M+Na]+ 244.09779 155.8
[M-H]- 220.10129 151.3
[M+NH4]+ 239.14239 169.1
[M+K]+ 260.07173 155.4
[M+H-H2O]+ 204.10583 144.1
[M+HCOO]- 266.10677 167.3
[M+CH3COO]- 280.12242 191.4
[M+Na-2H]- 242.08324 151.2
[M]+ 221.10802 155.6
[M]- 221.10912 155.6
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

No patent data available for this compound.