CID 64223042

(2-aminoethyl)[(2,3-dihydro-1h-inden-5-yl)methyl]methylamine dihydrochloride

Structural Information

Molecular Formula
C13H20N2
SMILES
CN(CCN)CC1=CC2=C(CCC2)C=C1
InChI
InChI=1S/C13H20N2/c1-15(8-7-14)10-11-5-6-12-3-2-4-13(12)9-11/h5-6,9H,2-4,7-8,10,14H2,1H3
InChIKey
APGXKFGNVOGUOK-UHFFFAOYSA-N
Compound name
N'-(2,3-dihydro-1H-inden-5-ylmethyl)-N'-methylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.16264 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.16992 147.8
[M+Na]+ 227.15186 153.1
[M-H]- 203.15536 152.6
[M+NH4]+ 222.19646 169.5
[M+K]+ 243.12580 150.7
[M+H-H2O]+ 187.15990 141.1
[M+HCOO]- 249.16084 172.1
[M+CH3COO]- 263.17649 194.8
[M+Na-2H]- 225.13731 151.8
[M]+ 204.16209 146.3
[M]- 204.16319 146.3
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.