CID 135922874

903906-73-0

Structural Information

Molecular Formula

C₁₂H₁₂N₂O

SMILES

C1CC2=C(/C(=N\O)/C1)C3=CC=CC=C3N2

InChI

InChI=1S/C12H12N2O/c15-14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13-10/h1-2,4-5,13,15H,3,6-7H2/b14-11-

InChIKey

MYJLWCZBXSLDMA-KAMYIIQDSA-N

Compound name

(NZ)-N-(1,2,3,9-tetrahydrocarbazol-4-ylidene)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 12
Patents: 200.09496 Da
Monoisotopic Mass: 2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	201.10224	141.6
[M+Na]+	223.08418	154.3
[M+NH4]+	218.12878	151.1
[M+K]+	239.05812	148.7
[M-H]-	199.08768	144.4
[M+Na-2H]-	221.06963	147.4
[M]+	200.09441	144.0
[M]-	200.09551	144.0

Literature stripe

literature stripe

Patent stripe

patents stripe