CID 15456

Meturedepa

Structural Information

Molecular Formula
C11H22N3O3P
SMILES
CCOC(=O)NP(=O)(N1CC1(C)C)N2CC2(C)C
InChI
InChI=1S/C11H22N3O3P/c1-6-17-9(15)12-18(16,13-7-10(13,2)3)14-8-11(14,4)5/h6-8H2,1-5H3,(H,12,15,16)
InChIKey
QTFKTBRIGWJQQL-UHFFFAOYSA-N
Compound name
ethyl N-bis(2,2-dimethylaziridin-1-yl)phosphorylcarbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

13
References

17279
Patents

275.1399 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.147176 182.1
[M+Na]+ 298.129118 189.6
[M-H]- 274.132624 186.1
[M+NH4]+ 293.173723 189.1
[M+K]+ 314.103058 189.1
[M+H-H2O]+ 258.137160 176.5
[M+HCOO]- 320.138101 201.7
[M+CH3COO]- 334.153751 211.0
[M+Na-2H]- 296.114566 182.2
[M]+ 275.13935142 190.5
[M]- 275.14044858 190.5
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

patents stripe