CID 210056

1,3,4,5-tetrahydro-1-(3-(dimethylamino)propyl)benz(cd)indole hydrochloride

Structural Information

Molecular Formula
C16H22N2
SMILES
CN(C)CCCN1C=C2CCCC3=C2C1=CC=C3
InChI
InChI=1S/C16H22N2/c1-17(2)10-5-11-18-12-14-8-3-6-13-7-4-9-15(18)16(13)14/h4,7,9,12H,3,5-6,8,10-11H2,1-2H3
InChIKey
YWETYQHGKFJNTO-UHFFFAOYSA-N
Compound name
3-(4,5-dihydro-3H-benzo[cd]indol-1-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.1783 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.18558 156.3
[M+Na]+ 265.16752 169.3
[M+NH4]+ 260.21212 166.5
[M+K]+ 281.14146 162.4
[M-H]- 241.17102 160.0
[M+Na-2H]- 263.15297 161.9
[M]+ 242.17775 159.3
[M]- 242.17885 159.3
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.