CID 39505

4-chloro-alpha-(methylimino)-o-cresol

Structural Information

Molecular Formula
C8H8ClNO
SMILES
CN=CC1=C(C=CC(=C1)Cl)O
InChI
InChI=1S/C8H8ClNO/c1-10-5-6-4-7(9)2-3-8(6)11/h2-5,11H,1H3
InChIKey
SJMVDYATGBLKAT-UHFFFAOYSA-N
Compound name
4-chloro-2-(methyliminomethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.02943 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.03671 131.2
[M+Na]+ 192.01865 145.3
[M+NH4]+ 187.06325 140.5
[M+K]+ 207.99259 137.8
[M-H]- 168.02215 134.3
[M+Na-2H]- 190.00410 139.1
[M]+ 169.02888 134.3
[M]- 169.02998 134.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.