CID 118170

34432-92-3

Structural Information

Molecular Formula
C22H31N3O2
SMILES
CCN(CCOC(C)OCC(C)C)C1=CC=C(C=C1)N=NC2=CC=CC=C2
InChI
InChI=1S/C22H31N3O2/c1-5-25(15-16-26-19(4)27-17-18(2)3)22-13-11-21(12-14-22)24-23-20-9-7-6-8-10-20/h6-14,18-19H,5,15-17H2,1-4H3
InChIKey
BATVZJPOLFSGTD-UHFFFAOYSA-N
Compound name
N-ethyl-N-[2-[1-(2-methylpropoxy)ethoxy]ethyl]-4-phenyldiazenylaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

347
Patents

369.24164 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.24892 194.6
[M+Na]+ 392.23086 196.5
[M-H]- 368.23436 203.8
[M+NH4]+ 387.27546 207.3
[M+K]+ 408.20480 195.5
[M+H-H2O]+ 352.23890 183.6
[M+HCOO]- 414.23984 221.3
[M+CH3COO]- 428.25549 234.6
[M+Na-2H]- 390.21631 196.4
[M]+ 369.24109 200.4
[M]- 369.24219 200.4
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