CID 42904

N,n,9-trimethyl-1,2,3,4-tetrahydrocarbazole-1-ethanamine hydrochloride

Structural Information

Molecular Formula
C17H24N2
SMILES
CN1C2=CC=CC=C2C3=C1C(CCC3)CCN(C)C
InChI
InChI=1S/C17H24N2/c1-18(2)12-11-13-7-6-9-15-14-8-4-5-10-16(14)19(3)17(13)15/h4-5,8,10,13H,6-7,9,11-12H2,1-3H3
InChIKey
XVNWCVRBPQJSMJ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(9-methyl-1,2,3,4-tetrahydrocarbazol-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.19394 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.20122 161.9
[M+Na]+ 279.18316 169.5
[M-H]- 255.18666 167.1
[M+NH4]+ 274.22776 182.3
[M+K]+ 295.15710 165.5
[M+H-H2O]+ 239.19120 154.2
[M+HCOO]- 301.19214 182.9
[M+CH3COO]- 315.20779 174.1
[M+Na-2H]- 277.16861 165.7
[M]+ 256.19339 163.5
[M]- 256.19449 163.5
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.