CID 3033790

101491-52-5

Structural Information

Molecular Formula
C17H33N4O5P
SMILES
CC1(CC(CC(N1OC)(C)C)OCCOC(=O)NP(=O)(N2CC2)N3CC3)C
InChI
InChI=1S/C17H33N4O5P/c1-16(2)12-14(13-17(3,4)21(16)24-5)25-10-11-26-15(22)18-27(23,19-6-7-19)20-8-9-20/h14H,6-13H2,1-5H3,(H,18,22,23)
InChIKey
PLRWYZPDQZCORD-UHFFFAOYSA-N
Compound name
2-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl N-[bis(aziridin-1-yl)phosphoryl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

404.21887 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.22615 213.8
[M+Na]+ 427.20809 217.9
[M-H]- 403.21159 217.5
[M+NH4]+ 422.25269 214.7
[M+K]+ 443.18203 217.4
[M+H-H2O]+ 387.21613 206.8
[M+HCOO]- 449.21707 228.5
[M+CH3COO]- 463.23272 230.0
[M+Na-2H]- 425.19354 210.7
[M]+ 404.21832 221.2
[M]- 404.21942 221.2
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.