CID 11438749

443965-10-4

Structural Information

Molecular Formula
C19H20NO2P
SMILES
CN(C)P1OC2=CC=CC3=C2C4(CC3)CCC5=C4C(=CC=C5)O1
InChI
InChI=1S/C19H20NO2P/c1-20(2)23-21-15-7-3-5-13-9-11-19(17(13)15)12-10-14-6-4-8-16(22-23)18(14)19/h3-8H,9-12H2,1-2H3
InChIKey
RIDZEECIONITMW-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4,5,6,7-tetrahydroiindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin-12-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

325.12317 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.13045 192.2
[M+Na]+ 348.11239 196.4
[M-H]- 324.11589 195.4
[M+NH4]+ 343.15699 201.4
[M+K]+ 364.08633 196.1
[M+H-H2O]+ 308.12043 186.4
[M+HCOO]- 370.12137 200.8
[M+CH3COO]- 384.13702 195.1
[M+Na-2H]- 346.09784 187.8
[M]+ 325.12262 193.0
[M]- 325.12372 193.0
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.