CID 6444349

Nsc 91873

Structural Information

Molecular Formula
C19H20N
SMILES
C[N+](C)(C)C1=CC=C(C=C1)/C=C\2/C=CC3=CC=CC=C32
InChI
InChI=1S/C19H20N/c1-20(2,3)18-12-8-15(9-13-18)14-17-11-10-16-6-4-5-7-19(16)17/h4-14H,1-3H3/q+1/b17-14-
InChIKey
UVWCPIQCXZWCMU-VKAVYKQESA-N
Compound name
[4-[(Z)-inden-1-ylidenemethyl]phenyl]-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.15958 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.16686 162.9
[M+Na]+ 285.14880 170.7
[M-H]- 261.15230 172.2
[M+NH4]+ 280.19340 182.9
[M+K]+ 301.12274 160.0
[M+H-H2O]+ 245.15684 158.6
[M+HCOO]- 307.15778 186.8
[M+CH3COO]- 321.17343 196.5
[M+Na-2H]- 283.13425 171.0
[M]+ 262.15903 162.3
[M]- 262.16013 162.3
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.