CID 3069093

84298-41-9

Structural Information

Molecular Formula
C16H23N3
SMILES
CC1CC2=C(CN1)N(C3=CC=CC=C23)CCN(C)C
InChI
InChI=1S/C16H23N3/c1-12-10-14-13-6-4-5-7-15(13)19(9-8-18(2)3)16(14)11-17-12/h4-7,12,17H,8-11H2,1-3H3
InChIKey
VPDPQIQCIHLNHZ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(3-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-9-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

257.1892 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.19648 162.1
[M+Na]+ 280.17842 169.8
[M-H]- 256.18192 164.6
[M+NH4]+ 275.22302 180.4
[M+K]+ 296.15236 165.0
[M+H-H2O]+ 240.18646 153.9
[M+HCOO]- 302.18740 180.6
[M+CH3COO]- 316.20305 173.2
[M+Na-2H]- 278.16387 166.0
[M]+ 257.18865 162.1
[M]- 257.18975 162.1
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

patents stripe