CID 159841

2-methylnorharman

Structural Information

Molecular Formula
C12H12N2
SMILES
CN1C=CC2C3=CC=CC=C3NC2=C1
InChI
InChI=1S/C12H12N2/c1-14-7-6-10-9-4-2-3-5-11(9)13-12(10)8-14/h2-8,10,13H,1H3
InChIKey
DIYOOFCVGXXOJG-UHFFFAOYSA-N
Compound name
2-methyl-4a,9-dihydropyrido[3,4-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

162
Patents

184.10005 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.10733 139.4
[M+Na]+ 207.08927 148.9
[M-H]- 183.09277 141.0
[M+NH4]+ 202.13387 160.1
[M+K]+ 223.06321 143.7
[M+H-H2O]+ 167.09731 132.3
[M+HCOO]- 229.09825 157.9
[M+CH3COO]- 243.11390 152.1
[M+Na-2H]- 205.07472 146.5
[M]+ 184.09950 137.2
[M]- 184.10060 137.2
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

No patent data available for this compound.