CID 206833

Brn 0749174

Structural Information

Molecular Formula
C14H19N3
SMILES
CN(C)CC1=CN2CCNCC3=C2C1=CC=C3
InChI
InChI=1S/C14H19N3/c1-16(2)9-12-10-17-7-6-15-8-11-4-3-5-13(12)14(11)17/h3-5,10,15H,6-9H2,1-2H3
InChIKey
LMCHXRDFLXWUDM-UHFFFAOYSA-N
Compound name
1-(1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.1579 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.16518 148.7
[M+Na]+ 252.14712 159.1
[M+NH4]+ 247.19172 157.1
[M+K]+ 268.12106 155.4
[M-H]- 228.15062 150.7
[M+Na-2H]- 250.13257 153.7
[M]+ 229.15735 150.7
[M]- 229.15845 150.7
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

No patent data available for this compound.