CID 44151427

Tazimcarb

Structural Information

Molecular Formula
C8H13N3O3S
SMILES
CC1(C(=O)N(C(=NOC(=O)NC)S1)C)C
InChI
InChI=1S/C8H13N3O3S/c1-8(2)5(12)11(4)6(15-8)10-14-7(13)9-3/h1-4H3,(H,9,13)
InChIKey
NPYQHCFKDKPILU-UHFFFAOYSA-N
Compound name
[(3,5,5-trimethyl-4-oxo-1,3-thiazolidin-2-ylidene)amino] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

3468
Patents

231.06776 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.07504 146.7
[M+Na]+ 254.05698 155.2
[M-H]- 230.06048 150.9
[M+NH4]+ 249.10158 168.2
[M+K]+ 270.03092 154.3
[M+H-H2O]+ 214.06502 141.5
[M+HCOO]- 276.06596 166.4
[M+CH3COO]- 290.08161 193.4
[M+Na-2H]- 252.04243 148.3
[M]+ 231.06721 150.1
[M]- 231.06831 150.1
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