CID 162582

50265-78-6

Structural Information

Molecular Formula

C₉H₁₈N₂O

SMILES

CC(C)(C)N=NC1(CCCC1)O

InChI

InChI=1S/C9H18N2O/c1-8(2,3)10-11-9(12)6-4-5-7-9/h12H,4-7H2,1-3H3

InChIKey

KTYBPHCWSCRLKK-UHFFFAOYSA-N

Compound name

1-(tert-butyldiazenyl)cyclopentan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 170.1419 Da
Monoisotopic Mass: 1.7
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]+	171.14918	137.9
[M+Na]+	193.13112	143.5
[M-H]-	169.13462	142.5
[M+NH4]+	188.17572	162.2
[M+K]+	209.10506	143.6
[M+H-H2O]+	153.13916	133.1
[M+HCOO]-	215.14010	162.6
[M+CH3COO]-	229.15575	184.2
[M+Na-2H]-	191.11657	145.1
[M]+	170.14135	136.3
[M]-	170.14245	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe