CID 64464

Brn 6874494

Structural Information

Molecular Formula
C15H25N4O2P
SMILES
C1CN1P(=O)(NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CC5
InChI
InChI=1S/C15H25N4O2P/c20-14(17-22(21,18-1-2-18)19-3-4-19)16-15-8-11-5-12(9-15)7-13(6-11)10-15/h11-13H,1-10H2,(H2,16,17,20,21)
InChIKey
RFSCKMLXAPNLFZ-UHFFFAOYSA-N
Compound name
1-(1-adamantyl)-3-[bis(aziridin-1-yl)phosphoryl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

324.1715 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.17878 184.0
[M+Na]+ 347.16072 185.1
[M-H]- 323.16422 181.0
[M+NH4]+ 342.20532 190.4
[M+K]+ 363.13466 181.8
[M+H-H2O]+ 307.16876 175.1
[M+HCOO]- 369.16970 189.4
[M+CH3COO]- 383.18535 187.1
[M+Na-2H]- 345.14617 188.3
[M]+ 324.17095 186.3
[M]- 324.17205 186.3
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.