CID 13725249

104222-32-4

Structural Information

Molecular Formula
C16H32N4O8
SMILES
CC(C)(C(=O)NC(CO)(CO)CO)N=NC(C)(C)C(=O)NC(CO)(CO)CO
InChI
InChI=1S/C16H32N4O8/c1-13(2,11(27)17-15(5-21,6-22)7-23)19-20-14(3,4)12(28)18-16(8-24,9-25)10-26/h21-26H,5-10H2,1-4H3,(H,17,27)(H,18,28)
InChIKey
BUGISVZCMXHOHO-UHFFFAOYSA-N
Compound name
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-[[1-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]diazenyl]-2-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5337
Patents

408.22202 Da
Monoisotopic Mass

-3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.22930 207.0
[M+Na]+ 431.21124 195.5
[M+NH4]+ 426.25584 188.7
[M+K]+ 447.18518 186.2
[M-H]- 407.21474 189.0
[M+Na-2H]- 429.19669 193.7
[M]+ 408.22147 186.0
[M]- 408.22257 186.0
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