CID 5275733

Dimethylaminomethyl[?]amine

Structural Information

Molecular Formula
C14H20N2
SMILES
CN(C)C[C@H]1[C@@H](C2CC1C3=CC=CC=C23)N
InChI
InChI=1S/C14H20N2/c1-16(2)8-13-11-7-12(14(13)15)10-6-4-3-5-9(10)11/h3-6,11-14H,7-8,15H2,1-2H3/t11?,12?,13-,14-/m1/s1
InChIKey
UBMYMFHJZCKJTM-NWINJMCUSA-N
Compound name
(9R,10S)-10-[(dimethylamino)methyl]tricyclo[6.2.1.02,7]undeca-2,4,6-trien-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.16264 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.16992 150.7
[M+Na]+ 239.15186 157.9
[M-H]- 215.15536 155.7
[M+NH4]+ 234.19646 175.8
[M+K]+ 255.12580 154.8
[M+H-H2O]+ 199.15990 145.5
[M+HCOO]- 261.16084 173.5
[M+CH3COO]- 275.17649 163.7
[M+Na-2H]- 237.13731 153.3
[M]+ 216.16209 150.4
[M]- 216.16319 150.4
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.