CID 44153640

2h-1,2,6-thiadiazine-3,5(4h,6h)-dione, 2,6-dicyclohexyl-4-(2-methylpropyl)-, 1,1-dioxide

Structural Information

Molecular Formula
C19H32N2O4S
SMILES
CC(C)CC1C(=O)N(S(=O)(=O)N(C1=O)C2CCCCC2)C3CCCCC3
InChI
InChI=1S/C19H32N2O4S/c1-14(2)13-17-18(22)20(15-9-5-3-6-10-15)26(24,25)21(19(17)23)16-11-7-4-8-12-16/h14-17H,3-13H2,1-2H3
InChIKey
KTBKDOCENFQCMU-UHFFFAOYSA-N
Compound name
2,6-dicyclohexyl-4-(2-methylpropyl)-1,1-dioxo-1,2,6-thiadiazinane-3,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.20828 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.21556 190.6
[M+Na]+ 407.19750 192.8
[M-H]- 383.20100 195.0
[M+NH4]+ 402.24210 201.2
[M+K]+ 423.17144 189.1
[M+H-H2O]+ 367.20554 181.8
[M+HCOO]- 429.20648 194.4
[M+CH3COO]- 443.22213 217.2
[M+Na-2H]- 405.18295 184.8
[M]+ 384.20773 184.2
[M]- 384.20883 184.2
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.