CID 212570

Lm 2911

Structural Information

Molecular Formula
C20H23N2O
SMILES
C[N+](C)(C)CCON=C1C2=CC=CC=C2C=CC3=CC=CC=C31
InChI
InChI=1S/C20H23N2O/c1-22(2,3)14-15-23-21-20-18-10-6-4-8-16(18)12-13-17-9-5-7-11-19(17)20/h4-13H,14-15H2,1-3H3/q+1
InChIKey
SQLCSPLHNACFQC-UHFFFAOYSA-N
Compound name
trimethyl-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylideneamino)oxyethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.18103 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.18831 173.9
[M+Na]+ 330.17025 180.7
[M-H]- 306.17375 183.3
[M+NH4]+ 325.21485 191.0
[M+K]+ 346.14419 175.9
[M+H-H2O]+ 290.17829 170.5
[M+HCOO]- 352.17923 198.3
[M+CH3COO]- 366.19488 210.6
[M+Na-2H]- 328.15570 185.7
[M]+ 307.18048 175.0
[M]- 307.18158 175.0
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.