CID 3088387

3-(3,5-di-t-butyl-4-hydroxyphenyl)-6-oxo-6,7-dihydro-2h-imidazo(2,1-b)(1,3,4)thiadiazine hbr

Structural Information

Molecular Formula
C19H25N3O2S
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=NN3C(=O)CN=C3SC2
InChI
InChI=1S/C19H25N3O2S/c1-18(2,3)12-7-11(8-13(16(12)24)19(4,5)6)14-10-25-17-20-9-15(23)22(17)21-14/h7-8,24H,9-10H2,1-6H3
InChIKey
FOGLUHIFPVAMJK-UHFFFAOYSA-N
Compound name
3-(3,5-ditert-butyl-4-hydroxyphenyl)-2,7-dihydroimidazo[2,1-b][1,3,4]thiadiazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

359.16675 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.17403 189.8
[M+Na]+ 382.15597 201.2
[M+NH4]+ 377.20057 196.0
[M+K]+ 398.12991 195.9
[M-H]- 358.15947 190.6
[M+Na-2H]- 380.14142 193.1
[M]+ 359.16620 192.2
[M]- 359.16730 192.2
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

No patent data available for this compound.