CID 44276288

Brn 6235430

Structural Information

Molecular Formula
C8H24N9P3
SMILES
CNP1(=NP(=NP(=N1)(N2CC2)N3CC3)(NC)NC)NC
InChI
InChI=1S/C8H24N9P3/c1-9-18(10-2)13-19(11-3,12-4)15-20(14-18,16-5-6-16)17-7-8-17/h9-12H,5-8H2,1-4H3
InChIKey
VWUIOOVOZAXLCD-UHFFFAOYSA-N
Compound name
6,6-bis(aziridin-1-yl)-2-N,2-N',4-N,4-N'-tetramethyl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene-2,2,4,4-tetramine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

339.13675 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.14403 193.6
[M+Na]+ 362.12597 199.2
[M-H]- 338.12947 194.6
[M+NH4]+ 357.17057 196.2
[M+K]+ 378.09991 198.7
[M+H-H2O]+ 322.13401 182.8
[M+HCOO]- 384.13495 223.3
[M+CH3COO]- 398.15060 228.0
[M+Na-2H]- 360.11142 193.0
[M]+ 339.13620 197.6
[M]- 339.13730 197.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.