CID 3047330

4-chloro-alpha(sup 2)-(methylimino)-2,6-xylenol

Structural Information

Molecular Formula
C9H10ClNO
SMILES
CC1=CC(=CC(=C1O)C=NC)Cl
InChI
InChI=1S/C9H10ClNO/c1-6-3-8(10)4-7(5-11-2)9(6)12/h3-5,12H,1-2H3
InChIKey
SUHCAAXMORNNCR-UHFFFAOYSA-N
Compound name
4-chloro-2-methyl-6-(methyliminomethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.04509 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.05237 135.5
[M+Na]+ 206.03431 149.8
[M+NH4]+ 201.07891 144.7
[M+K]+ 222.00825 142.2
[M-H]- 182.03781 138.6
[M+Na-2H]- 204.01976 142.9
[M]+ 183.04454 138.7
[M]- 183.04564 138.7
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.

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No patent data available for this compound.