CID 3015790

O-hydroxyphenyl carbamate

Structural Information

Molecular Formula
C7H7NO3
SMILES
C1=CC=C(C(=C1)O)OC(=O)N
InChI
InChI=1S/C7H7NO3/c8-7(10)11-6-4-2-1-3-5(6)9/h1-4,9H,(H2,8,10)
InChIKey
BIHORWRPXKVBIH-UHFFFAOYSA-N
Compound name
(2-hydroxyphenyl) carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

153.04259 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.049866 128.1
[M+Na]+ 176.031808 136.0
[M-H]- 152.035314 130.5
[M+NH4]+ 171.076413 148.0
[M+K]+ 192.005748 134.7
[M+H-H2O]+ 136.039850 122.6
[M+HCOO]- 198.040791 152.1
[M+CH3COO]- 212.056441 173.4
[M+Na-2H]- 174.017256 134.1
[M]+ 153.04204142 126.9
[M]- 153.04313858 126.9
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