CID 146155895

2416234-34-7

Structural Information

Molecular Formula
C9H20N2O4S
SMILES
CC(C)(C)OC(=O)NCCS(=N)(=O)CCO
InChI
InChI=1S/C9H20N2O4S/c1-9(2,3)15-8(13)11-4-6-16(10,14)7-5-12/h10,12H,4-7H2,1-3H3,(H,11,13)
InChIKey
YZOBTFZBZFVEKQ-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(2-hydroxyethylsulfonimidoyl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.11438 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.121656 157.2
[M+Na]+ 275.103598 161.7
[M-H]- 251.107104 155.6
[M+NH4]+ 270.148203 173.3
[M+K]+ 291.077538 159.8
[M+H-H2O]+ 235.111640 151.6
[M+HCOO]- 297.112581 172.2
[M+CH3COO]- 311.128231 192.4
[M+Na-2H]- 273.089046 160.4
[M]+ 252.11383142 159.5
[M]- 252.11492858 159.5
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

No patent data available for this compound.