CID 31946

23509-37-7

Structural Information

Molecular Formula
C19H23N
SMILES
CN(C)CCC1C2=CC=CC=C2CCC3=CC=CC=C13
InChI
InChI=1S/C19H23N/c1-20(2)14-13-19-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)19/h3-10,19H,11-14H2,1-2H3
InChIKey
IGIICXQCPSJBDK-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.18304 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.19032 161.4
[M+Na]+ 288.17226 166.4
[M-H]- 264.17576 168.6
[M+NH4]+ 283.21686 179.5
[M+K]+ 304.14620 166.2
[M+H-H2O]+ 248.18030 155.9
[M+HCOO]- 310.18124 181.8
[M+CH3COO]- 324.19689 172.7
[M+Na-2H]- 286.15771 167.3
[M]+ 265.18249 159.1
[M]- 265.18359 159.1
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.