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

141
Patents

153.04259 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.04987 128.1
[M+Na]+ 176.03181 135.1
[M-H]- 152.03531 130.6
[M+NH4]+ 171.07641 148.0
[M+K]+ 192.00575 134.1
[M+H-H2O]+ 136.03985 122.3
[M+HCOO]- 198.04079 152.7
[M+CH3COO]- 212.05644 172.2
[M+Na-2H]- 174.01726 135.9
[M]+ 153.04204 127.4
[M]- 153.04314 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