CID 108277

54915-23-0

Structural Information

Molecular Formula
C15H19N
SMILES
C=CCN1CC2CCC(C1)C3=CC=CC=C23
InChI
InChI=1S/C15H19N/c1-2-9-16-10-12-7-8-13(11-16)15-6-4-3-5-14(12)15/h2-6,12-13H,1,7-11H2
InChIKey
GVANDLJZUQOPMA-UHFFFAOYSA-N
Compound name
10-prop-2-enyl-10-azatricyclo[6.3.2.02,7]trideca-2,4,6-triene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.15175 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15903 156.9
[M+Na]+ 236.14097 165.2
[M-H]- 212.14447 159.4
[M+NH4]+ 231.18557 176.7
[M+K]+ 252.11491 160.4
[M+H-H2O]+ 196.14901 156.6
[M+HCOO]- 258.14995 168.3
[M+CH3COO]- 272.16560 166.6
[M+Na-2H]- 234.12642 165.7
[M]+ 213.15120 155.4
[M]- 213.15230 155.4
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.