CID 146170528

Uv1

Structural Information

Molecular Formula
C11H11NO2
SMILES
COC1=CC=CC2=NC(=O)CCC=C21
InChI
InChI=1S/C11H11NO2/c1-14-10-6-3-5-9-8(10)4-2-7-11(13)12-9/h3-6H,2,7H2,1H3
InChIKey
DRMBRISDJOVCJR-UHFFFAOYSA-N
Compound name
6-methoxy-3,4-dihydro-1-benzazepin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.07898 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.08626 133.9
[M+Na]+ 212.06820 142.5
[M-H]- 188.07170 139.0
[M+NH4]+ 207.11280 152.6
[M+K]+ 228.04214 144.3
[M+H-H2O]+ 172.07624 128.5
[M+HCOO]- 234.07718 156.4
[M+CH3COO]- 248.09283 184.6
[M+Na-2H]- 210.05365 142.6
[M]+ 189.07843 133.7
[M]- 189.07953 133.7
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.