CID 14892433

69258-88-4

Structural Information

Molecular Formula
C8H9N3O
SMILES
C1=CC(=CC=C1CCO)N=[N+]=[N-]
InChI
InChI=1S/C8H9N3O/c9-11-10-8-3-1-7(2-4-8)5-6-12/h1-4,12H,5-6H2
InChIKey
NASVKGVQQLAHPV-UHFFFAOYSA-N
Compound name
2-(4-azidophenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

33
Patents

163.07455 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.081826 130.5
[M+Na]+ 186.063768 137.5
[M-H]- 162.067274 135.7
[M+NH4]+ 181.108373 150.7
[M+K]+ 202.037708 131.2
[M+H-H2O]+ 146.071810 128.7
[M+HCOO]- 208.072751 161.0
[M+CH3COO]- 222.088401 178.7
[M+Na-2H]- 184.049216 141.5
[M]+ 163.07400142 128.1
[M]- 163.07509858 128.1
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

patents stripe