CID 6510169

Ethanone, 1-(1-methoxycyclohexyl)-, o-((phenylamino)carbonyl)oxime

Structural Information

Molecular Formula
C16H22N2O3
SMILES
C/C(=N/OC(=O)NC1=CC=CC=C1)/C2(CCCCC2)OC
InChI
InChI=1S/C16H22N2O3/c1-13(16(20-2)11-7-4-8-12-16)18-21-15(19)17-14-9-5-3-6-10-14/h3,5-6,9-10H,4,7-8,11-12H2,1-2H3,(H,17,19)/b18-13-
InChIKey
PDMRBLGFJHVTIC-AQTBWJFISA-N
Compound name
[(Z)-1-(1-methoxycyclohexyl)ethylideneamino] N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.16306 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.170336 168.5
[M+Na]+ 313.152278 170.8
[M-H]- 289.155784 175.1
[M+NH4]+ 308.196883 185.1
[M+K]+ 329.126218 169.8
[M+H-H2O]+ 273.160320 160.3
[M+HCOO]- 335.161261 190.5
[M+CH3COO]- 349.176911 205.3
[M+Na-2H]- 311.137726 172.5
[M]+ 290.16251142 166.1
[M]- 290.16360858 166.1
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.