CID 6071809

50823-55-7

Structural Information

Molecular Formula
C14H19NO4
SMILES
COC1=C(C(=C2C/C(=N\O)/CCCC2=C1)OC)OC
InChI
InChI=1S/C14H19NO4/c1-17-12-7-9-5-4-6-10(15-16)8-11(9)13(18-2)14(12)19-3/h7,16H,4-6,8H2,1-3H3/b15-10-
InChIKey
RCAKSFBHTACZEL-GDNBJRDFSA-N
Compound name
(NZ)-N-(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1314 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.138676 155.0
[M+Na]+ 288.120618 160.7
[M-H]- 264.124124 160.8
[M+NH4]+ 283.165223 171.9
[M+K]+ 304.094558 164.2
[M+H-H2O]+ 248.128660 149.6
[M+HCOO]- 310.129601 176.2
[M+CH3COO]- 324.145251 201.5
[M+Na-2H]- 286.106066 159.3
[M]+ 265.13085142 155.2
[M]- 265.13194858 155.2
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.