CID 26181

13683-89-1

Structural Information

Molecular Formula
C8H9NO3
SMILES
COC(=O)NC1=CC(=CC=C1)O
InChI
InChI=1S/C8H9NO3/c1-12-8(11)9-6-3-2-4-7(10)5-6/h2-5,10H,1H3,(H,9,11)
InChIKey
FFQQCJGNKKIRMD-UHFFFAOYSA-N
Compound name
methyl N-(3-hydroxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

989
Patents

167.05824 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.06552 133.3
[M+Na]+ 190.04746 144.4
[M+NH4]+ 185.09206 140.7
[M+K]+ 206.02140 139.7
[M-H]- 166.05096 134.5
[M+Na-2H]- 188.03291 139.3
[M]+ 167.05769 134.9
[M]- 167.05879 134.9
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