CID 201103

1h-pyrido(2,3-b)indole, 2,3,4,9-tetrahydro-6-methoxy-1-methyl-

Structural Information

Molecular Formula
C13H16N2O
SMILES
CN1CCCC2=C1NC3=C2C=C(C=C3)OC
InChI
InChI=1S/C13H16N2O/c1-15-7-3-4-10-11-8-9(16-2)5-6-12(11)14-13(10)15/h5-6,8,14H,3-4,7H2,1-2H3
InChIKey
FSPWAFNUZMFVRQ-UHFFFAOYSA-N
Compound name
6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[2,3-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.12627 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.13355 148.0
[M+Na]+ 239.11549 157.8
[M-H]- 215.11899 149.8
[M+NH4]+ 234.16009 167.7
[M+K]+ 255.08943 153.0
[M+H-H2O]+ 199.12353 140.9
[M+HCOO]- 261.12447 166.3
[M+CH3COO]- 275.14012 160.4
[M+Na-2H]- 237.10094 153.8
[M]+ 216.12572 148.0
[M]- 216.12682 148.0
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.