CID 3088665

Brn 6020032

Structural Information

Molecular Formula
C20H32Cl2N4O3P
SMILES
CC1(CC(CC(N1[O])(C)C)NP(=O)(NC(=O)C2=CC=CC=C2)N(CCCl)CCCl)C
InChI
InChI=1S/C20H32Cl2N4O3P/c1-19(2)14-17(15-20(3,4)26(19)28)23-30(29,25(12-10-21)13-11-22)24-18(27)16-8-6-5-7-9-16/h5-9,17H,10-15H2,1-4H3,(H2,23,24,27,29)
InChIKey
UZZQRVZSAWQVCR-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

477.1589 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 478.16618 205.7
[M+Na]+ 500.14812 213.4
[M+NH4]+ 495.19272 212.8
[M+K]+ 516.12206 204.7
[M-H]- 476.15162 207.6
[M+Na-2H]- 498.13357 212.1
[M]+ 477.15835 207.8
[M]- 477.15945 207.8
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.