CID 57803

7-benzofuranol, 2,3-dihydro-2,2-dimethyl-, n-hydroxycarbamate

Structural Information

Molecular Formula
C11H13NO4
SMILES
CC1(CC2=C(O1)C(=CC=C2)OC(=O)NO)C
InChI
InChI=1S/C11H13NO4/c1-11(2)6-7-4-3-5-8(9(7)16-11)15-10(13)12-14/h3-5,14H,6H2,1-2H3,(H,12,13)
InChIKey
VEQZKZAZNDSRSY-UHFFFAOYSA-N
Compound name
(2,2-dimethyl-3H-1-benzofuran-7-yl) N-hydroxycarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.08446 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.09174 145.9
[M+Na]+ 246.07368 154.3
[M-H]- 222.07718 150.4
[M+NH4]+ 241.11828 167.1
[M+K]+ 262.04762 153.7
[M+H-H2O]+ 206.08172 141.4
[M+HCOO]- 268.08266 167.7
[M+CH3COO]- 282.09831 186.3
[M+Na-2H]- 244.05913 152.6
[M]+ 223.08391 148.2
[M]- 223.08501 148.2
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

No patent data available for this compound.