CID 13086940

6740-87-0

Structural Information

Molecular Formula
C13H16ClNO
SMILES
CN=C(C1=CC=CC=C1Cl)C2(CCCC2)O
InChI
InChI=1S/C13H16ClNO/c1-15-12(13(16)8-4-5-9-13)10-6-2-3-7-11(10)14/h2-3,6-7,16H,4-5,8-9H2,1H3
InChIKey
FJGPXUPMNZOTLX-UHFFFAOYSA-N
Compound name
1-[C-(2-chlorophenyl)-N-methylcarbonimidoyl]cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

237.09204 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.09932 153.2
[M+Na]+ 260.08126 164.7
[M+NH4]+ 255.12586 163.8
[M+K]+ 276.05520 157.2
[M-H]- 236.08476 157.3
[M+Na-2H]- 258.06671 161.6
[M]+ 237.09149 156.3
[M]- 237.09259 156.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe