CID 6366646

74056-26-1

Structural Information

Molecular Formula
C26H29NO
SMILES
CCN(CC)CCOC1=CC=C(C=C1)/C(=C/C2=CC=CC=C2)/C3=CC=CC=C3
InChI
InChI=1S/C26H29NO/c1-3-27(4-2)19-20-28-25-17-15-24(16-18-25)26(23-13-9-6-10-14-23)21-22-11-7-5-8-12-22/h5-18,21H,3-4,19-20H2,1-2H3/b26-21+
InChIKey
YOKPBLYAKJJMQO-YYADALCUSA-N
Compound name
2-[4-[(E)-1,2-diphenylethenyl]phenoxy]-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

64
Patents

371.2249 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.23218 195.6
[M+Na]+ 394.21412 198.3
[M-H]- 370.21762 204.9
[M+NH4]+ 389.25872 206.9
[M+K]+ 410.18806 192.7
[M+H-H2O]+ 354.22216 184.6
[M+HCOO]- 416.22310 217.9
[M+CH3COO]- 430.23875 224.4
[M+Na-2H]- 392.19957 197.1
[M]+ 371.22435 196.7
[M]- 371.22545 196.7
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