CID 76669

3204-68-0

Structural Information

Molecular Formula
C15H18N
SMILES
C[N+](C)(CC1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C15H18N/c1-16(2,15-11-7-4-8-12-15)13-14-9-5-3-6-10-14/h3-12H,13H2,1-2H3/q+1
InChIKey
FFZVILRAPIUNAA-UHFFFAOYSA-N
Compound name
benzyl-dimethyl-phenylazanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1321
Patents

212.14392 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15120 147.7
[M+Na]+ 235.13314 153.7
[M-H]- 211.13664 155.7
[M+NH4]+ 230.17774 166.5
[M+K]+ 251.10708 145.2
[M+H-H2O]+ 195.14118 143.2
[M+HCOO]- 257.14212 172.2
[M+CH3COO]- 271.15777 186.6
[M+Na-2H]- 233.11859 158.9
[M]+ 212.14337 146.2
[M]- 212.14447 146.2
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.