CID 423999

9-(10-undecenamino)julolidine dihydrochloride

Structural Information

Molecular Formula
C23H36N2
SMILES
C=CCCCCCCCCCNC1=CC2=C3C(=C1)CCCN3CCC2
InChI
InChI=1S/C23H36N2/c1-2-3-4-5-6-7-8-9-10-15-24-22-18-20-13-11-16-25-17-12-14-21(19-22)23(20)25/h2,18-19,24H,1,3-17H2
InChIKey
PKWOBGQCQVIFTJ-UHFFFAOYSA-N
Compound name
N-undec-10-enyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.28784 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.29512 188.5
[M+Na]+ 363.27706 189.4
[M-H]- 339.28056 188.4
[M+NH4]+ 358.32166 202.2
[M+K]+ 379.25100 182.6
[M+H-H2O]+ 323.28510 178.7
[M+HCOO]- 385.28604 201.8
[M+CH3COO]- 399.30169 219.9
[M+Na-2H]- 361.26251 190.7
[M]+ 340.28729 186.3
[M]- 340.28839 186.3
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.