CID 148233

Phenyl n-hydroxycarbamate

Structural Information

Molecular Formula
C7H7NO3
SMILES
C1=CC=C(C=C1)OC(=O)NO
InChI
InChI=1S/C7H7NO3/c9-7(8-10)11-6-4-2-1-3-5-6/h1-5,10H,(H,8,9)
InChIKey
JADMRVSHKZTLPH-UHFFFAOYSA-N
Compound name
phenyl N-hydroxycarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

145
Patents

153.04259 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.049866 128.1
[M+Na]+ 176.031808 135.1
[M-H]- 152.035314 130.6
[M+NH4]+ 171.076413 148.0
[M+K]+ 192.005748 134.1
[M+H-H2O]+ 136.039850 122.3
[M+HCOO]- 198.040791 152.7
[M+CH3COO]- 212.056441 172.2
[M+Na-2H]- 174.017256 135.9
[M]+ 153.04204142 127.4
[M]- 153.04313858 127.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe