CID 103778

Brn 0019723

Structural Information

Molecular Formula
C18H30N2
SMILES
C1CCC2(CC1)C3CCCCC3=NC4(N2)CCCCC4
InChI
InChI=1S/C18H30N2/c1-5-11-17(12-6-1)15-9-3-4-10-16(15)19-18(20-17)13-7-2-8-14-18/h15,20H,1-14H2
InChIKey
SGXQCZNWVQHZMM-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

18
Patents

274.2409 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.24818 176.3
[M+Na]+ 297.23012 186.3
[M+NH4]+ 292.27472 189.1
[M+K]+ 313.20406 173.6
[M-H]- 273.23362 180.9
[M+Na-2H]- 295.21557 182.7
[M]+ 274.24035 179.2
[M]- 274.24145 179.2
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

patents stripe