CID 34452

H.c. 9001

Structural Information

Molecular Formula
C16H33N4O2P
SMILES
C[N+](C)(C)CCNP(=O)(NCC[N+](C)(C)C)OC1=CC=CC=C1
InChI
InChI=1S/C16H33N4O2P/c1-19(2,3)14-12-17-23(21,18-13-15-20(4,5)6)22-16-10-8-7-9-11-16/h7-11H,12-15H2,1-6H3,(H2,17,18,21)/q+2
InChIKey
ZGWHJCXRBAXZMW-UHFFFAOYSA-N
Compound name
trimethyl-[2-[[phenoxy-[2-(trimethylazaniumyl)ethylamino]phosphoryl]amino]ethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.2341 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.24138 214.4
[M+Na]+ 367.22332 219.8
[M+NH4]+ 362.26792 222.1
[M+K]+ 383.19726 224.6
[M-H]- 343.22682 209.9
[M+Na-2H]- 365.20877 208.7
[M]+ 344.23355 215.7
[M]- 344.23465 215.7
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.