CID 2794174

N-benzyl-6-methyl-2,3,4,9-tetrahydro-1h-carbazol-1-amine hydrochloride

Structural Information

Molecular Formula
C20H22N2
SMILES
CC1=CC2=C(C=C1)NC3=C2CCCC3NCC4=CC=CC=C4
InChI
InChI=1S/C20H22N2/c1-14-10-11-18-17(12-14)16-8-5-9-19(20(16)22-18)21-13-15-6-3-2-4-7-15/h2-4,6-7,10-12,19,21-22H,5,8-9,13H2,1H3
InChIKey
QFDFWFMCDCUQNX-UHFFFAOYSA-N
Compound name
N-benzyl-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

10
Patents

290.17828 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.18556 167.5
[M+Na]+ 313.16750 174.7
[M-H]- 289.17100 173.1
[M+NH4]+ 308.21210 184.6
[M+K]+ 329.14144 167.1
[M+H-H2O]+ 273.17554 159.0
[M+HCOO]- 335.17648 186.9
[M+CH3COO]- 349.19213 178.2
[M+Na-2H]- 311.15295 172.5
[M]+ 290.17773 164.7
[M]- 290.17883 164.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe