CID 202881

Brn 0482514

Structural Information

Molecular Formula
C17H18N2
SMILES
CN(C)CC1=C2C=CC=CN2C=C1C3=CC=CC=C3
InChI
InChI=1S/C17H18N2/c1-18(2)12-16-15(14-8-4-3-5-9-14)13-19-11-7-6-10-17(16)19/h3-11,13H,12H2,1-2H3
InChIKey
CWZHFLRQJUOTAI-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(2-phenylindolizin-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

250.147 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.15428 157.7
[M+Na]+ 273.13622 166.6
[M-H]- 249.13972 165.9
[M+NH4]+ 268.18082 176.9
[M+K]+ 289.11016 162.2
[M+H-H2O]+ 233.14426 149.2
[M+HCOO]- 295.14520 183.4
[M+CH3COO]- 309.16085 171.1
[M+Na-2H]- 271.12167 163.8
[M]+ 250.14645 160.7
[M]- 250.14755 160.7
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

patents stripe