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]+ 224.091736 145.9
[M+Na]+ 246.073678 154.3
[M-H]- 222.077184 150.4
[M+NH4]+ 241.118283 167.1
[M+K]+ 262.047618 153.7
[M+H-H2O]+ 206.081720 141.4
[M+HCOO]- 268.082661 167.7
[M+CH3COO]- 282.098311 186.3
[M+Na-2H]- 244.059126 152.6
[M]+ 223.08391142 148.2
[M]- 223.08500858 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.