CID 11452018

N,n,2,6-tetramethyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine

Structural Information

Molecular Formula
C24H22NO2P
SMILES
CC1=CC2=CC=CC=C2C3=C1OP(OC4=C3C5=CC=CC=C5C=C4C)N(C)C
InChI
InChI=1S/C24H22NO2P/c1-15-13-17-9-5-7-11-19(17)21-22-20-12-8-6-10-18(20)14-16(2)24(22)27-28(25(3)4)26-23(15)21/h5-14H,1-4H3
InChIKey
MXASPZVRFOFONU-UHFFFAOYSA-N
Compound name
N,N,10,16-tetramethyl-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

387.13882 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.14610 198.9
[M+Na]+ 410.12804 210.1
[M-H]- 386.13154 210.0
[M+NH4]+ 405.17264 212.8
[M+K]+ 426.10198 211.3
[M+H-H2O]+ 370.13608 190.0
[M+HCOO]- 432.13702 223.4
[M+CH3COO]- 446.15267 210.4
[M+Na-2H]- 408.11349 203.3
[M]+ 387.13827 205.0
[M]- 387.13937 205.0
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

patents stripe