CID 11564693

372960-11-7

Structural Information

Molecular Formula
C12H16N2O
SMILES
CC(C)(C)/C=N/NC(=O)C1=CC=CC=C1
InChI
InChI=1S/C12H16N2O/c1-12(2,3)9-13-14-11(15)10-7-5-4-6-8-10/h4-9H,1-3H3,(H,14,15)/b13-9+
InChIKey
AMSONEKMVLMUKM-UKTHLTGXSA-N
Compound name
N-[(E)-2,2-dimethylpropylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

204.12627 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.13355 147.0
[M+Na]+ 227.11549 152.9
[M-H]- 203.11899 151.9
[M+NH4]+ 222.16009 166.3
[M+K]+ 243.08943 151.3
[M+H-H2O]+ 187.12353 140.6
[M+HCOO]- 249.12447 172.3
[M+CH3COO]- 263.14012 192.1
[M+Na-2H]- 225.10094 154.2
[M]+ 204.12572 147.1
[M]- 204.12682 147.1
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