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]+ 205.169916 147.8
[M+Na]+ 227.151858 153.1
[M-H]- 203.155364 152.6
[M+NH4]+ 222.196463 169.5
[M+K]+ 243.125798 150.7
[M+H-H2O]+ 187.159900 141.1
[M+HCOO]- 249.160841 172.1
[M+CH3COO]- 263.176491 194.8
[M+Na-2H]- 225.137306 151.8
[M]+ 204.16209142 146.3
[M]- 204.16318858 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.