CID 43146939

2,3-dihydro-1,4-benzodioxine-6-sulfonohydrazide

Structural Information

Molecular Formula
C8H10N2O4S
SMILES
C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NN
InChI
InChI=1S/C8H10N2O4S/c9-10-15(11,12)6-1-2-7-8(5-6)14-4-3-13-7/h1-2,5,10H,3-4,9H2
InChIKey
RCOZJNBLQHDSPI-UHFFFAOYSA-N
Compound name
2,3-dihydro-1,4-benzodioxine-6-sulfonohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.03613 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.04341 143.0
[M+Na]+ 253.02535 150.3
[M-H]- 229.02885 148.3
[M+NH4]+ 248.06995 158.8
[M+K]+ 268.99929 150.0
[M+H-H2O]+ 213.03339 137.0
[M+HCOO]- 275.03433 159.2
[M+CH3COO]- 289.04998 188.4
[M+Na-2H]- 251.01080 152.3
[M]+ 230.03558 143.7
[M]- 230.03668 143.7
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.