CID 169444895

(r)-3-(methyl(nitroso)amino)-2,3,4,9-tetrahydro-1h-carbazole-6-carboxamide

Structural Information

Molecular Formula
C14H16N4O2
SMILES
CN([C@@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N)N=O
InChI
InChI=1S/C14H16N4O2/c1-18(17-20)9-3-5-13-11(7-9)10-6-8(14(15)19)2-4-12(10)16-13/h2,4,6,9,16H,3,5,7H2,1H3,(H2,15,19)/t9-/m1/s1
InChIKey
LCHAUZPEVOSSJQ-SECBINFHSA-N
Compound name
(6R)-6-[methyl(nitroso)amino]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.12732 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.13460 157.6
[M+Na]+ 295.11654 164.7
[M-H]- 271.12004 162.8
[M+NH4]+ 290.16114 175.8
[M+K]+ 311.09048 161.9
[M+H-H2O]+ 255.12458 149.9
[M+HCOO]- 317.12552 180.8
[M+CH3COO]- 331.14117 209.3
[M+Na-2H]- 293.10199 162.6
[M]+ 272.12677 156.9
[M]- 272.12787 156.9
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.