CID 9576162

3-methyl-2-butanone phenylhydrazone

Structural Information

Molecular Formula
C11H16N2
SMILES
CC(C)/C(=N/NC1=CC=CC=C1)/C
InChI
InChI=1S/C11H16N2/c1-9(2)10(3)12-13-11-7-5-4-6-8-11/h4-9,13H,1-3H3/b12-10+
InChIKey
FMMTYPMNEMQQSY-ZRDIBKRKSA-N
Compound name
N-[(E)-3-methylbutan-2-ylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5
Patents

176.13135 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.138626 140.9
[M+Na]+ 199.120568 146.0
[M-H]- 175.124074 145.6
[M+NH4]+ 194.165173 161.0
[M+K]+ 215.094508 144.8
[M+H-H2O]+ 159.128610 134.2
[M+HCOO]- 221.129551 166.6
[M+CH3COO]- 235.145201 189.9
[M+Na-2H]- 197.106016 146.6
[M]+ 176.13080142 139.9
[M]- 176.13189858 139.9
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

patents stripe