CID 15217361

146322-08-9

Structural Information

Molecular Formula
C11H13NO3
SMILES
CC(CC1=CC2=C(C=C1)OCO2)/C=N/O
InChI
InChI=1S/C11H13NO3/c1-8(6-12-13)4-9-2-3-10-11(5-9)15-7-14-10/h2-3,5-6,8,13H,4,7H2,1H3/b12-6+
InChIKey
ISLHQWBNLXYVQG-WUXMJOGZSA-N
Compound name
(NE)-N-[3-(1,3-benzodioxol-5-yl)-2-methylpropylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

0
Patents

207.08954 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 144.6
[M+Na]+ 230.07876 151.7
[M-H]- 206.08226 150.3
[M+NH4]+ 225.12336 163.4
[M+K]+ 246.05270 152.0
[M+H-H2O]+ 190.08680 139.0
[M+HCOO]- 252.08774 166.7
[M+CH3COO]- 266.10339 186.7
[M+Na-2H]- 228.06421 151.7
[M]+ 207.08899 147.1
[M]- 207.09009 147.1
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.